7-oxidanylidene-7-[4-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 7-oxidanylidene-7-[4-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 7-oxo-7-[4-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 7-oxo-7-[4-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 7-oxo-7-[4-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 7-keto-7-[4-(trifluoromethyl)phenyl]enanthonitrile Formula: C14H14F3NO MolecularWeight: 269.26227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCCCC#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCCCC#N)C(F)(F)F

InChI

InChI=1S/C14H14F3NO/c15-14(16,17)12-8-6-11(7-9-12)13(19)5-3-1-2-4-10-18/h6-9H,1-5H2