3-oxidanylidene-2-(4-propan-2-ylphenyl)pentanenitrile

Systemtic Name: 3-oxidanylidene-2-(4-propan-2-ylphenyl)pentanenitrile Openeye Name: 2-(4-isopropylphenyl)-3-oxo-pentanenitrile CAS Name: 3-oxo-2-(4-propan-2-ylphenyl)pentanenitrile IUPAC Name: 3-oxo-2-(4-propan-2-ylphenyl)pentanenitrile Traditional Name: 3-keto-2-p-cumenyl-valeronitrile Formula: C14H17NO MolecularWeight: 215.29088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-4-14(16)13(9-15)12-7-5-11(6-8-12)10(2)3/h5-8,10,13H,4H2,1-3H3