(E)-2-cyano-3-(4-pentoxyphenyl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-pentoxyphenyl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-pentoxyphenyl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(4-pentoxyphenyl)-N-[3-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-pentoxyphenyl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-amoxyphenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]acrylamide Formula: C22H21F3N2O2 MolecularWeight: 402.40955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C22H21F3N2O2/c1-2-3-4-12-29-20-10-8-16(9-11-20)13-17(15-26)21(28)27-19-7-5-6-18(14-19)22(23,24)25/h5-11,13-14H,2-4,12H2,1H3,(H,27,28)/b17-13+