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

Systemtic Name: dimethyl 5-cyano-3-naphthalen-2-ylcarbonyl-6-oxidanylidene-1H-pyridine-2,4-dicarboxylate Openeye Name: dimethyl 5-cyano-3-(naphthalene-2-carbonyl)-6-oxo-1H-pyridine-2,4-dicarboxylate CAS Name: 5-cyano-3-[2-naphthalenyl(oxo)methyl]-6-oxo-1H-pyridine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-cyano-3-(naphthalene-2-carbonyl)-6-oxo-1H-pyridine-2,4-dicarboxylate Traditional Name: 5-cyano-6-keto-3-(2-naphthoyl)-1H-pyridine-2,4-dicarboxylic acid dimethyl ester Formula: C21H14N2O6 MolecularWeight: 390.34566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OC)C#N

Isomeric SMILES

COC(=O)C1=C(C(=O)NC(=C1C(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OC)C#N

InChI

InChI=1S/C21H14N2O6/c1-28-20(26)15-14(10-22)19(25)23-17(21(27)29-2)16(15)18(24)13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,1-2H3,(H,23,25)