4,4-dimethyl-3-oxidanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile

Systemtic Name: 4,4-dimethyl-3-oxidanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile Openeye Name: 4,4-dimethyl-3-oxo-2-[3-(trifluoromethyl)phenyl]pentanenitrile CAS Name: 4,4-dimethyl-3-oxo-2-[3-(trifluoromethyl)phenyl]pentanenitrile IUPAC Name: 4,4-dimethyl-3-oxo-2-[3-(trifluoromethyl)phenyl]pentanenitrile Traditional Name: 3-keto-4,4-dimethyl-2-[3-(trifluoromethyl)phenyl]valeronitrile Formula: C14H14F3NO MolecularWeight: 269.26227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14F3NO/c1-13(2,3)12(19)11(8-18)9-5-4-6-10(7-9)14(15,16)17/h4-7,11H,1-3H3