4-[2,6-bis(oxidanylidene)-3-(trichloromethyl)cyclohexyl]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[2,6-bis(oxidanylidene)-3-(trichloromethyl)cyclohexyl]-3-chloranyl-benzenecarbonitrile Openeye Name: 3-chloro-4-[2,6-dioxo-3-(trichloromethyl)cyclohexyl]benzonitrile CAS Name: 3-chloro-4-[2,6-dioxo-3-(trichloromethyl)cyclohexyl]benzonitrile IUPAC Name: 3-chloro-4-[2,6-dioxo-3-(trichloromethyl)cyclohexyl]benzonitrile Traditional Name: 3-chloro-4-[2,6-diketo-3-(trichloromethyl)cyclohexyl]benzonitrile Formula: C14H9Cl4NO2 MolecularWeight: 365.03876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C(=O)C1C(Cl)(Cl)Cl)C2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

C1CC(=O)C(C(=O)C1C(Cl)(Cl)Cl)C2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C14H9Cl4NO2/c15-10-5-7(6-19)1-2-8(10)12-11(20)4-3-9(13(12)21)14(16,17)18/h1-2,5,9,12H,3-4H2