(2-oxidanylidene-2-pyridin-3-yl-ethyl) 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyridin-3-yl-ethyl) 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: [2-oxo-2-(3-pyridyl)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-(3-pyridinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyridin-3-ylethyl) 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-(3-pyridyl)ethyl] ester Formula: C24H17ClN2O4 MolecularWeight: 432.85578

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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)C4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H17ClN2O4/c1-27-22(24(30)31-14-20(28)16-5-4-12-26-13-16)21(15-8-10-17(25)11-9-15)18-6-2-3-7-19(18)23(27)29/h2-13H,14H2,1H3