2-[3-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[3-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]ethanenitrile Openeye Name: 2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile CAS Name: 2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile IUPAC Name: 2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile Traditional Name: 2-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile Formula: C11H10F3NO2 MolecularWeight: 245.19781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC#N)OCC(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CC#N)OCC(F)(F)F

InChI

InChI=1S/C11H10F3NO2/c1-16-10-6-8(4-5-15)2-3-9(10)17-7-11(12,13)14/h2-3,6H,4,7H2,1H3