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

Systemtic Name: methyl 2-[(3-chlorophenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[(3-chlorobenzoyl)amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[[(3-chlorophenyl)-oxomethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chlorobenzoyl)amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[(3-chlorobenzoyl)amino]-1-keto-isoquinoline-4-carboxylic acid methyl ester Formula: C18H13ClN2O4 MolecularWeight: 356.75982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H13ClN2O4/c1-25-18(24)15-10-21(17(23)14-8-3-2-7-13(14)15)20-16(22)11-5-4-6-12(19)9-11/h2-10H,1H3,(H,20,22)