methyl 1-[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-[N-(cyanomethyl)anilino]-2-oxo-ethyl]-5-nitro-2-oxo-pyridine-3-carboxylate CAS Name: 1-[2-[N-(cyanomethyl)anilino]-2-oxoethyl]-5-nitro-2-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[N-(cyanomethyl)anilino]-2-oxoethyl]-5-nitro-2-oxopyridine-3-carboxylate Traditional Name: 1-[2-[N-(cyanomethyl)anilino]-2-keto-ethyl]-2-keto-5-nitro-nicotinic acid methyl ester Formula: C17H14N4O6 MolecularWeight: 370.31626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN(C1=O)CC(=O)N(CC#N)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CN(C1=O)CC(=O)N(CC#N)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O6/c1-27-17(24)14-9-13(21(25)26)10-19(16(14)23)11-15(22)20(8-7-18)12-5-3-2-4-6-12/h2-6,9-10H,8,11H2,1H3