[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 1,3-bis(oxidanylidene)-2-(2-sulfanylphenyl)isoindole-5-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 1,3-bis(oxidanylidene)-2-(2-sulfanylphenyl)isoindole-5-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 1,3-dioxo-2-(2-sulfanylphenyl)isoindoline-5-carboxylate CAS Name: 2-(2-mercaptophenyl)-1,3-dioxo-5-isoindolecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 1,3-dioxo-2-(2-sulfanylphenyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(2-mercaptophenyl)isoindoline-5-carboxylic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C24H17NO6S MolecularWeight: 447.45988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4S

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4S

InChI

InChI=1S/C24H17NO6S/c1-30-16-9-6-14(7-10-16)20(26)13-31-24(29)15-8-11-17-18(12-15)23(28)25(22(17)27)19-4-2-3-5-21(19)32/h2-12,32H,13H2,1H3