2-[3-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: 2-[3-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: 2-[3-(trifluoromethyl)phenyl]acetonitrile CAS Name: 2-[3-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: 2-[3-(trifluoromethyl)phenyl]acetonitrile Traditional Name: 2-[3-(trifluoromethyl)phenyl]acetonitrile Formula: C9H6F3N MolecularWeight: 185.14585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4H2