[2-(diphenylamino)-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [2-(diphenylamino)-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: [2-oxo-2-(N-phenylanilino)ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [2-oxo-2-(N-phenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-phenylanilino)ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid [2-keto-2-(N-phenylanilino)ethyl] ester Formula: C31H23ClN2O4 MolecularWeight: 522.97832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)Cl)C(=O)OCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)Cl)C(=O)OCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H23ClN2O4/c1-33-29(28(21-16-18-22(32)19-17-21)25-14-8-9-15-26(25)30(33)36)31(37)38-20-27(35)34(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-19H,20H2,1H3