3-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: 3-oxidanylidene-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: 3-oxo-1-phenyl-cyclohexanecarbonitrile CAS Name: 3-oxo-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: 3-oxo-1-phenylcyclohexane-1-carbonitrile Traditional Name: 3-keto-1-phenyl-cyclohexanecarbonitrile Formula: C13H13NO MolecularWeight: 199.24842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CC(C1)(C#N)C2=CC=CC=C2

Isomeric SMILES

C1CC(=O)CC(C1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H13NO/c14-10-13(8-4-7-12(15)9-13)11-5-2-1-3-6-11/h1-3,5-6H,4,7-9H2