4-[4-[bis(fluoranyl)methoxy]phenyl]-2-methyl-butanenitrile

Systemtic Name: 4-[4-[bis(fluoranyl)methoxy]phenyl]-2-methyl-butanenitrile Openeye Name: 4-[4-(difluoromethoxy)phenyl]-2-methyl-butanenitrile CAS Name: 4-[4-(difluoromethoxy)phenyl]-2-methylbutanenitrile IUPAC Name: 4-[4-(difluoromethoxy)phenyl]-2-methylbutanenitrile Traditional Name: 4-[4-(difluoromethoxy)phenyl]-2-methyl-butyronitrile Formula: C12H13F2NO MolecularWeight: 225.234526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC(F)F)C#N

Isomeric SMILES

CC(CCC1=CC=C(C=C1)OC(F)F)C#N

InChI

InChI=1S/C12H13F2NO/c1-9(8-15)2-3-10-4-6-11(7-5-10)16-12(13)14/h4-7,9,12H,2-3H2,1H3