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

Systemtic Name: 4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-3-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(4,4-dimethyl-2,6-dioxo-cyclohexyl)-3-(trifluoromethyl)benzonitrile CAS Name: 4-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-(trifluoromethyl)benzonitrile IUPAC Name: 4-(4,4-dimethyl-2,6-dioxocyclohexyl)-3-(trifluoromethyl)benzonitrile Traditional Name: 4-(2,6-diketo-4,4-dimethyl-cyclohexyl)-3-(trifluoromethyl)benzonitrile Formula: C16H14F3NO2 MolecularWeight: 309.28307

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2=C(C=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2=C(C=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C16H14F3NO2/c1-15(2)6-12(21)14(13(22)7-15)10-4-3-9(8-20)5-11(10)16(17,18)19/h3-5,14H,6-7H2,1-2H3