(E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-(2-pyridyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (E)-3-[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-(2-pyridyl)acrylonitrile Formula: C22H14F3N3O4 MolecularWeight: 441.35947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=CC=N2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C#N)\C2=CC=CC=N2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H14F3N3O4/c1-31-21-11-14(10-15(13-26)17-4-2-3-9-27-17)5-7-20(21)32-19-8-6-16(22(23,24)25)12-18(19)28(29)30/h2-12H,1H3/b15-10-