methyl (E)-3-[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]acrylic acid methyl ester Formula: C13H10F2N2O6 MolecularWeight: 328.225106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F2N2O6/c1-21-10-4-7(3-8(6-16)12(18)22-2)9(17(19)20)5-11(10)23-13(14)15/h3-5,13H,1-2H3/b8-3+