[2-[4-(3-methoxyphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(3-methoxyphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: [2-[4-(3-methoxybenzoyl)oxyphenyl]-2-oxo-ethyl] 8-methyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 8-methyl-2-thiophen-2-yl-4-quinolinecarboxylic acid [2-[4-[(3-methoxyphenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methoxybenzoyl)oxyphenyl]-2-oxoethyl] 8-methyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 8-methyl-2-(2-thienyl)cinchoninic acid [2-keto-2-(4-m-anisoyloxyphenyl)ethyl] ester Formula: C31H23NO6S MolecularWeight: 537.58242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)OC)C5=CC=CS5

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)OC)C5=CC=CS5

InChI

InChI=1S/C31H23NO6S/c1-19-6-3-9-24-25(17-26(32-29(19)24)28-10-5-15-39-28)31(35)37-18-27(33)20-11-13-22(14-12-20)38-30(34)21-7-4-8-23(16-21)36-2/h3-17H,18H2,1-2H3