3-oxidanylidene-2-phenyl-heptanenitrile

Systemtic Name: 3-oxidanylidene-2-phenyl-heptanenitrile Openeye Name: 3-oxo-2-phenyl-heptanenitrile CAS Name: 3-oxo-2-phenylheptanenitrile IUPAC Name: 3-oxo-2-phenylheptanenitrile Traditional Name: 3-keto-2-phenyl-enanthonitrile Formula: C13H15NO MolecularWeight: 201.2643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-2-3-9-13(15)12(10-14)11-7-5-4-6-8-11/h4-8,12H,2-3,9H2,1H3