5-[1,1-bis(fluoranyl)ethyl]-2-(trifluoromethyloxy)benzenecarbonitrile

Systemtic Name: 5-[1,1-bis(fluoranyl)ethyl]-2-(trifluoromethyloxy)benzenecarbonitrile Openeye Name: 5-(1,1-difluoroethyl)-2-(trifluoromethoxy)benzonitrile CAS Name: 5-(1,1-difluoroethyl)-2-(trifluoromethoxy)benzonitrile IUPAC Name: 5-(1,1-difluoroethyl)-2-(trifluoromethoxy)benzonitrile Traditional Name: 5-(1,1-difluoroethyl)-2-(trifluoromethoxy)benzonitrile Formula: C10H6F5NO MolecularWeight: 251.152756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H6F5NO/c1-9(11,12)7-2-3-8(6(4-7)5-16)17-10(13,14)15/h2-4H,1H3