(E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide

Systemtic Name: (E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide Openeye Name: (E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methyl-5-nitro-benzofuran-3-yl)but-2-enamide CAS Name: (E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methyl-5-nitro-3-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide Traditional Name: (E)-N-homoveratryl-3-(2-methyl-5-nitro-benzofuran-3-yl)but-2-enamide Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=CC(=O)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])/C(=C/C(=O)NCCC3=CC(=C(C=C3)OC)OC)/C

InChI

InChI=1S/C23H24N2O6/c1-14(23-15(2)31-19-8-6-17(25(27)28)13-18(19)23)11-22(26)24-10-9-16-5-7-20(29-3)21(12-16)30-4/h5-8,11-13H,9-10H2,1-4H3,(H,24,26)/b14-11+