2-[3-bromanyl-5-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[3-bromanyl-5-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]ethanenitrile Openeye Name: 2-[3-bromo-5-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile CAS Name: 2-[3-bromo-5-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile IUPAC Name: 2-[3-bromo-5-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile Traditional Name: 2-[3-bromo-5-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]acetonitrile Formula: C11H9BrF3NO2 MolecularWeight: 324.09387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9BrF3NO2/c1-17-9-5-7(2-3-16)4-8(12)10(9)18-6-11(13,14)15/h4-5H,2,6H2,1H3