4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-methyl-benzenecarbonitrile

Systemtic Name: 4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-methyl-benzenecarbonitrile Openeye Name: 4-(4,4-dimethyl-2,6-dioxo-cyclohexyl)-3-methyl-benzonitrile CAS Name: 4-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-methylbenzonitrile IUPAC Name: 4-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-methylbenzonitrile Traditional Name: 4-(2,6-diketo-4,4-dimethyl-cyclohexyl)-3-methyl-benzonitrile Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#N)C2C(=O)CC(CC2=O)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C#N)C2C(=O)CC(CC2=O)(C)C

InChI

InChI=1S/C16H17NO2/c1-10-6-11(9-17)4-5-12(10)15-13(18)7-16(2,3)8-14(15)19/h4-6,15H,7-8H2,1-3H3