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

Systemtic Name: dimethyl 2-[[1-[(3-fluorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-[(3-fluorophenyl)methyl]-2-oxo-pyridine-3-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-[(3-fluorophenyl)methyl]-2-oxo-3-pyridinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-[(3-fluorophenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(3-fluorobenzyl)-2-keto-nicotinoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C23H19FN2O6 MolecularWeight: 438.405163

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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=C3)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CN(C2=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H19FN2O6/c1-31-22(29)15-8-9-17(23(30)32-2)19(12-15)25-20(27)18-7-4-10-26(21(18)28)13-14-5-3-6-16(24)11-14/h3-12H,13H2,1-2H3,(H,25,27)