dimethyl 5-cyano-3-(4-fluorophenyl)carbonyl-6-oxidanylidene-1H-pyridine-2,4-dicarboxylate

Systemtic Name: dimethyl 5-cyano-3-(4-fluorophenyl)carbonyl-6-oxidanylidene-1H-pyridine-2,4-dicarboxylate Openeye Name: dimethyl 5-cyano-3-(4-fluorobenzoyl)-6-oxo-1H-pyridine-2,4-dicarboxylate CAS Name: 5-cyano-3-[(4-fluorophenyl)-oxomethyl]-6-oxo-1H-pyridine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-cyano-3-(4-fluorobenzoyl)-6-oxo-1H-pyridine-2,4-dicarboxylate Traditional Name: 5-cyano-3-(4-fluorobenzoyl)-6-keto-1H-pyridine-2,4-dicarboxylic acid dimethyl ester Formula: C17H11FN2O6 MolecularWeight: 358.277443

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC=C(C=C2)F)C(=O)OC)C#N

Isomeric SMILES

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC=C(C=C2)F)C(=O)OC)C#N

InChI

InChI=1S/C17H11FN2O6/c1-25-16(23)11-10(7-19)15(22)20-13(17(24)26-2)12(11)14(21)8-3-5-9(18)6-4-8/h3-6H,1-2H3,(H,20,22)