5-hexanoyl-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 5-hexanoyl-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 5-hexanoyl-6-methyl-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 6-methyl-2-oxo-5-(1-oxohexyl)-1H-pyridine-3-carbonitrile IUPAC Name: 5-hexanoyl-6-methyl-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-caproyl-2-keto-6-methyl-1H-pyridine-3-carbonitrile Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2/c1-3-4-5-6-12(16)11-7-10(8-14)13(17)15-9(11)2/h7H,3-6H2,1-2H3,(H,15,17)