3-[3,5-bis(oxidanylidene)cyclohexyl]benzenecarbonitrile

Systemtic Name: 3-[3,5-bis(oxidanylidene)cyclohexyl]benzenecarbonitrile Openeye Name: 3-(3,5-dioxocyclohexyl)benzonitrile CAS Name: 3-(3,5-dioxocyclohexyl)benzonitrile IUPAC Name: 3-(3,5-dioxocyclohexyl)benzonitrile Traditional Name: 3-(3,5-diketocyclohexyl)benzonitrile Formula: C13H11NO2 MolecularWeight: 213.23194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)CC1=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1C(CC(=O)CC1=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H11NO2/c14-8-9-2-1-3-10(4-9)11-5-12(15)7-13(16)6-11/h1-4,11H,5-7H2