3-methyl-4-[3-methyl-2,5-bis(oxidanylidene)cyclopentyl]benzenecarbonitrile

Systemtic Name: 3-methyl-4-[3-methyl-2,5-bis(oxidanylidene)cyclopentyl]benzenecarbonitrile Openeye Name: 3-methyl-4-(3-methyl-2,5-dioxo-cyclopentyl)benzonitrile CAS Name: 3-methyl-4-(3-methyl-2,5-dioxocyclopentyl)benzonitrile IUPAC Name: 3-methyl-4-(3-methyl-2,5-dioxocyclopentyl)benzonitrile Traditional Name: 4-(2,5-diketo-3-methyl-cyclopentyl)-3-methyl-benzonitrile Formula: C14H13NO2 MolecularWeight: 227.25852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C1=O)C2=C(C=C(C=C2)C#N)C

Isomeric SMILES

CC1CC(=O)C(C1=O)C2=C(C=C(C=C2)C#N)C

InChI

InChI=1S/C14H13NO2/c1-8-5-10(7-15)3-4-11(8)13-12(16)6-9(2)14(13)17/h3-5,9,13H,6H2,1-2H3