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

Systemtic Name: 3-methylbutyl 5-cyano-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: isopentyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-2-methyl-1H-pyridine-3-carboxylic acid isoamyl ester Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1)C#N)C(=O)OCCC(C)C

Isomeric SMILES

CC1=C(C=C(C(=O)N1)C#N)C(=O)OCCC(C)C

InChI

InChI=1S/C13H16N2O3/c1-8(2)4-5-18-13(17)11-6-10(7-14)12(16)15-9(11)3/h6,8H,4-5H2,1-3H3,(H,15,16)