dimethyl 5-cyano-6-oxidanylidene-3-pyridin-2-ylcarbonyl-1H-pyridine-2,4-dicarboxylate

Systemtic Name: dimethyl 5-cyano-6-oxidanylidene-3-pyridin-2-ylcarbonyl-1H-pyridine-2,4-dicarboxylate Openeye Name: dimethyl 5-cyano-6-oxo-3-(pyridine-2-carbonyl)-1H-pyridine-2,4-dicarboxylate CAS Name: 5-cyano-6-oxo-3-[oxo(2-pyridinyl)methyl]-1H-pyridine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-cyano-6-oxo-3-(pyridine-2-carbonyl)-1H-pyridine-2,4-dicarboxylate Traditional Name: 5-cyano-6-keto-3-picolinoyl-1H-pyridine-2,4-dicarboxylic acid dimethyl ester Formula: C16H11N3O6 MolecularWeight: 341.27504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC=CC=N2)C(=O)OC)C#N

Isomeric SMILES

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC=CC=N2)C(=O)OC)C#N

InChI

InChI=1S/C16H11N3O6/c1-24-15(22)10-8(7-17)14(21)19-12(16(23)25-2)11(10)13(20)9-5-3-4-6-18-9/h3-6H,1-2H3,(H,19,21)