butyl 5-cyano-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: butyl 5-cyano-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: butyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylic acid butyl ester IUPAC Name: butyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-2-methyl-1H-pyridine-3-carboxylic acid butyl ester Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=O)C(=C1)C#N)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=O)C(=C1)C#N)C

InChI

InChI=1S/C12H14N2O3/c1-3-4-5-17-12(16)10-6-9(7-13)11(15)14-8(10)2/h6H,3-5H2,1-2H3,(H,14,15)