(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-N-[2-(trifluoromethyl)phenyl]acrylamide Formula: C21H16BrF3N2O3 MolecularWeight: 481.26255

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(F)(F)F)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2C(F)(F)F)Br)OCC=C

InChI

InChI=1S/C21H16BrF3N2O3/c1-3-8-30-19-16(22)10-13(11-18(19)29-2)9-14(12-26)20(28)27-17-7-5-4-6-15(17)21(23,24)25/h3-7,9-11H,1,8H2,2H3,(H,27,28)/b14-9+