5-oxidanylidene-2-propan-2-yl-2-pyridin-2-yl-pentanenitrile

Systemtic Name: 5-oxidanylidene-2-propan-2-yl-2-pyridin-2-yl-pentanenitrile Openeye Name: 2-isopropyl-5-oxo-2-(2-pyridyl)pentanenitrile CAS Name: 5-oxo-2-propan-2-yl-2-(2-pyridinyl)pentanenitrile IUPAC Name: 5-oxo-2-propan-2-yl-2-pyridin-2-ylpentanenitrile Traditional Name: 2-isopropyl-5-keto-2-(2-pyridyl)valeronitrile Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC=O)(C#N)C1=CC=CC=N1

Isomeric SMILES

CC(C)C(CCC=O)(C#N)C1=CC=CC=N1

InChI

InChI=1S/C13H16N2O/c1-11(2)13(10-14,7-5-9-16)12-6-3-4-8-15-12/h3-4,6,8-9,11H,5,7H2,1-2H3