3-(1-butyl-5-cyano-2,4-dimethyl-6-oxidanylidene-pyridin-3-yl)propanoate

Systemtic Name: 3-(1-butyl-5-cyano-2,4-dimethyl-6-oxidanylidene-pyridin-3-yl)propanoate Openeye Name: 3-(1-butyl-5-cyano-2,4-dimethyl-6-oxo-3-pyridyl)propanoate CAS Name: 3-(1-butyl-5-cyano-2,4-dimethyl-6-oxo-3-pyridinyl)propanoate IUPAC Name: 3-(1-butyl-5-cyano-2,4-dimethyl-6-oxopyridin-3-yl)propanoate Traditional Name: 3-(1-butyl-5-cyano-6-keto-2,4-dimethyl-3-pyridyl)propionate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C(C1=O)C#N)C)CCC(=O)[O-])C

Isomeric SMILES

CCCCN1C(=C(C(=C(C1=O)C#N)C)CCC(=O)[O-])C

InChI

InChI=1S/C15H20N2O3/c1-4-5-8-17-11(3)12(6-7-14(18)19)10(2)13(9-16)15(17)20/h4-8H2,1-3H3,(H,18,19)/p-1