methyl 5-cyano-1-[2-(1-methylpyrrol-3-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[2-(1-methylpyrrol-3-yl)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[2-(1-methylpyrrol-3-yl)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[2-(1-methyl-3-pyrrolyl)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[2-(1-methylpyrrol-3-yl)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-1-[2-keto-2-(1-methylpyrrol-3-yl)ethyl]nicotinic acid methyl ester Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C(=O)CN2C=C(C=C(C2=O)C#N)C(=O)OC

Isomeric SMILES

CN1C=CC(=C1)C(=O)CN2C=C(C=C(C2=O)C#N)C(=O)OC

InChI

InChI=1S/C15H13N3O4/c1-17-4-3-10(7-17)13(19)9-18-8-12(15(21)22-2)5-11(6-16)14(18)20/h3-5,7-8H,9H2,1-2H3