[2-oxidanylidene-2-(4-thiophen-2-ylcarbonyloxyphenyl)ethyl] 7-chloranyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonyloxyphenyl)ethyl] 7-chloranyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyloxy)phenyl]ethyl] 7-chloro-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 7-chloro-2-(4-methoxyphenyl)-8-methyl-4-quinolinecarboxylic acid [2-oxo-2-[4-[oxo(thiophen-2-yl)methoxy]phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyloxy)phenyl]ethyl] 7-chloro-2-(4-methoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 7-chloro-2-(4-methoxyphenyl)-8-methyl-cinchoninic acid [2-keto-2-[4-(2-thenoyloxy)phenyl]ethyl] ester Formula: C31H22ClNO6S MolecularWeight: 572.02748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=CS4)C5=CC=C(C=C5)OC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=CS4)C5=CC=C(C=C5)OC)Cl

InChI

InChI=1S/C31H22ClNO6S/c1-18-25(32)14-13-23-24(16-26(33-29(18)23)19-5-9-21(37-2)10-6-19)30(35)38-17-27(34)20-7-11-22(12-8-20)39-31(36)28-4-3-15-40-28/h3-16H,17H2,1-2H3