2-[2-nitro-5-propan-2-yloxy-4-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name: 2-[2-nitro-5-propan-2-yloxy-4-(trifluoromethyl)phenyl]ethanenitrile Openeye Name: 2-[5-isopropoxy-2-nitro-4-(trifluoromethyl)phenyl]acetonitrile CAS Name: 2-[2-nitro-5-propan-2-yloxy-4-(trifluoromethyl)phenyl]acetonitrile IUPAC Name: 2-[2-nitro-5-propan-2-yloxy-4-(trifluoromethyl)phenyl]acetonitrile Traditional Name: 2-[5-isopropoxy-2-nitro-4-(trifluoromethyl)phenyl]acetonitrile Formula: C12H11F3N2O3 MolecularWeight: 288.22255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])CC#N

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])CC#N

InChI

InChI=1S/C12H11F3N2O3/c1-7(2)20-11-5-8(3-4-16)10(17(18)19)6-9(11)12(13,14)15/h5-7H,3H2,1-2H3