dimethyl 2-[[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-[(2-chlorophenyl)methyl]-2-oxo-pyridine-3-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-[(2-chlorophenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(2-chlorobenzyl)-2-keto-nicotinoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C23H19ClN2O6 MolecularWeight: 454.85976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CN(C2=O)CC3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CN(C2=O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C23H19ClN2O6/c1-31-22(29)14-9-10-16(23(30)32-2)19(12-14)25-20(27)17-7-5-11-26(21(17)28)13-15-6-3-4-8-18(15)24/h3-12H,13H2,1-2H3,(H,25,27)