Hydroxybenzoic Acid Derivatives
Iopromide, TRC
CAS: 73334-07-3 Molecular Formula: C18 H24 I3 N3 O8 Molecular Weight (g/mol): 791.11 Synonym: Iopromide,N,N'-Bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methylbenzene-1,3-dicarboxamide,1,3-Benzenedicarboxamide, N1,N3-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-N1-methyl-,1,3-Benzenedicarboxamide, N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(methoxyacetyl)amino]-N-methyl- (9CI),Iopromide,Iopromidum,SHL 414C,Ultravist,Ultravist 300,Ultravist 370,ZK 35760 IUPAC Name: 1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-3-N-methylbenzene-1,3-dicarboxamide SMILES: COCC(=O)Nc1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I
Flurofamide, TRC
CAS: 70788-28-2 Molecular Formula: C7H9FN3O2P Molecular Weight (g/mol): 217.14 Synonym: 4-Fluoro-N-(diaminophosphinyl)benzamide,Flurfamide,NSC 342995 SMILES: NP(=O)(N)NC(=O)c1ccc(F)cc1
Lasmiditan, TRC
CAS: 439239-90-4 Molecular Formula: C19H18F3N3O2 Molecular Weight (g/mol): 377.36 Synonym: 2,4,6-Trifluoro-N-[6-(1-methylpiperidine-4-carbonyl)pyridin-2-yl]benzamide,2,4,6-Trifluoro-N-[6-[(1-methyl-4-piperidinyl)carbonyl]-2-pyridinyl]benzamide SMILES: CN1CCC(CC1)C(=O)c2cccc(NC(=O)c3c(F)cc(F)cc3F)n2
Propyzamide, TRC
CAS: 23950-58-5 Molecular Formula: C12 H11 Cl2 N O Molecular Weight (g/mol): 256.13 Synonym: Benzamide, 3,5-dichloro-N-(1,1-dimethyl-2-propyn-1-yl)-,Benzamide, 3,5-dichloro-N-(1,1-dimethyl-2-propynyl)- (8CI,9CI),3,5-Dichloro-N-(1,1-dimethyl-2-propyn-1-yl)benzamide,3,5-Dichloro-N-(1,1-dimethyl-2-propynyl)benzamide,3,5-Dichloro-N-(1,1-dimethylpropynyl)benzamide,Kerb,Kerb 50W,N-(1,1-Dimethylpropynyl)-3,5-dichlorobenzamide,Pronamide,Propyzamide,RH 315 IUPAC Name: 3,5-dichloro-N-(2-methylbut-3-yn-2-yl)benzamide SMILES: CC(C)(NC(=O)c1cc(Cl)cc(Cl)c1)C#C
Cholesterol Glucuronide, TRC
CAS: 17435-78-8 Molecular Formula: C33 H54 O7 Molecular Weight (g/mol): 562.778 IUPAC Name: (2S,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O
Berberrubine Chloride, TRC
CAS: 15401-69-1 Molecular Formula: C19H16ClNO4 Molecular Weight (g/mol): 357.79 Synonym: 9-Berberoline Chloride,9-Demethoxy-9-hydroxyberberinium Chloride,Berberrubine Chloride,Beroline Chloride; IUPAC Name: 17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-16-ol;chloride SMILES: [Cl-].COc1ccc2cc3c4cc5OCOc5cc4CC[n+]3cc2c1O
Labetalol Hydrochloride, TRC
CAS: 32780-64-6 Molecular Formula: C19 H24 N2 O3 . Cl H Molecular Weight (g/mol): 364.87 Synonym: Benzamide, 2-hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]-, hydrochloride (1:1),Benzamide, 2-hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]-, monohydrochloride (9CI),Salicylamide, 5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]-, monohydrochloride (8CI),AH 5158 hydrochloride,AH 5158A,Amipress,Ipolab,Labelol,Labetalol hydrochloride,Labracol,NSC 290312,Normodyne,Presdate,Pressalolo,Sch 15719W,Trandate,Vescal IUPAC Name: 2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide;hydrochloride SMILES: Cl.CC(CCc1ccccc1)NCC(O)c2ccc(O)c(c2)C(=O)N
Ginkgolic Acid, TRC
CAS: 20261-38-5 Molecular Formula: C20 H32 O3 Molecular Weight (g/mol): 320.47 Synonym: Benzoic acid, 2-hydroxy-6-tridecyl-,Salicylic acid, 6-tridecyl- (8CI),2-Hydroxy-6-tridecylbenzoic acid,6-Tridecylsalicylic acid,6-n-Tridecylsalicylic acid,Ginkgoneolic acid IUPAC Name: 2-hydroxy-6-tridecylbenzoic acid SMILES: CCCCCCCCCCCCCc1cccc(O)c1C(=O)O
2,6-Difluorobenzamide, TRC
CAS: 18063-03-1 Molecular Formula: C7 H5 F2 N O Molecular Weight (g/mol): 157.12 Synonym: Benzamide, 2,6-difluoro-,2,6-Difluorobenzamide,Lufenuron Imp. A (EP) IUPAC Name: 2,6-difluorobenzamide SMILES: NC(=O)c1c(F)cccc1F
Iobitridol (>90%), TRC
CAS: 136949-58-1 Molecular Formula: C20 H28 I3 N3 O9 Molecular Weight (g/mol): 835.16 IUPAC Name: 1-N,3-N-bis(2,3-dihydroxypropyl)-5-[[3-hydroxy-2-(hydroxymethyl)propanoyl]amino]-2,4,6-triiodo-1-N,3-N-dimethylbenzene-1,3-dicarboxamide SMILES: CN(CC(O)CO)C(=O)c1c(I)c(NC(=O)C(CO)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I
3-Chlorosalicylic Acid, TRC
CAS: 1829-32-9 Molecular Formula: C7 H5 Cl O3 Molecular Weight (g/mol): 172.57 IUPAC Name: 3-chloro-2-hydroxybenzoic acid SMILES: OC(=O)c1cccc(Cl)c1O
2,3-Dihydroxybenzoic Acid, TRC
CAS: 303-38-8 Molecular Formula: C7 H6 O4 Molecular Weight (g/mol): 154.12 Synonym: Benzoic acid, 2,3-dihydroxy-,o-Pyrocatechuic acid (6CI,8CI),2,3-Dihydroxybenzoic acid,1,2-Dihydroxybenzene-3-carboxylic acid,3-Hydroxysalicylic acid,Catecholcarboxylic acid,NSC 27435,Pyrocatechuic acid IUPAC Name: 2,3-dihydroxybenzoic acid SMILES: OC(=O)c1cccc(O)c1O
4-Aminosalicylic Acid, TRC
CAS: 65-49-6 Molecular Formula: C7 H7 N O3 Molecular Weight (g/mol): 153.14 Synonym: Salicylic acid, 4-amino- (8CI),4-Amino-2-hydroxybenzoic acid,2-Hydroxy-4-aminobenzoic acid,3-Hydroxy-4-carboxyaniline,4-ASA,4-Aminosalicylic acid,4-Carboxy-3-hydroxyaniline,Amino-PAS,Apacil,Apas,Deapasil,Entepas,Euteropas,Gabbropas,Monopass,NSC 2083,NSC 211698,Osacyl,PAS,PAS (acid),PASK,Pamacyl,Pamisyl,Para-Pas,Para-aminosalicylic acid,Paramycin,Parasal,Parasalicil,Parasalindon,Pasa,Pasalon,Pasara,Pasem,Paser,Pasmed,Pasnodia,Pasolac,Propasa,Rezipas,Sanipirol-4,p-Aminosalicylic acid IUPAC Name: 4-amino-2-hydroxybenzoic acid SMILES: Nc1ccc(C(=O)O)c(O)c1
3-Aminosalicylic Acid, TRC
CAS: 570-23-0 Molecular Formula: C7 H7 N O3 Molecular Weight (g/mol): 153.14 Synonym: 3-Amino-2-hydroxybenzoic acid,Mesalazine Imp. F (EP),Benzoic acid, 3-amino-2-hydroxy-,Salicylic acid, 3-amino- (8CI),2-Hydroxy-3-aminobenzoic acid,3-Aminosalicylic acid,NSC 285111,TCI-A 0421 IUPAC Name: 3-amino-2-hydroxybenzoic acid SMILES: Nc1cccc(C(=O)O)c1O
- 1
- 2