5-oxidanylidene-2-propan-2-yl-2-pyridin-3-yl-pentanenitrile

Systemtic Name: 5-oxidanylidene-2-propan-2-yl-2-pyridin-3-yl-pentanenitrile Openeye Name: 2-isopropyl-5-oxo-2-(3-pyridyl)pentanenitrile CAS Name: 5-oxo-2-propan-2-yl-2-(3-pyridinyl)pentanenitrile IUPAC Name: 5-oxo-2-propan-2-yl-2-pyridin-3-ylpentanenitrile Traditional Name: 2-isopropyl-5-keto-2-(3-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=CN=CC=C1

Isomeric SMILES

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

InChI

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