(E)-3-[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]-2-cyano-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-3-[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]-N-phenethyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]-N-phenethyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]-N-phenethylprop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]-N-phenethyl-acrylamide Formula: C20H17F2N3O5 MolecularWeight: 417.362886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NCCC2=CC=CC=C2)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C20H17F2N3O5/c1-29-17-10-14(16(25(27)28)11-18(17)30-20(21)22)9-15(12-23)19(26)24-8-7-13-5-3-2-4-6-13/h2-6,9-11,20H,7-8H2,1H3,(H,24,26)/b15-9+