(E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-N-(2-methyl-4-nitro-phenyl)but-2-enamide

Systemtic Name: (E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-N-(2-methyl-4-nitro-phenyl)but-2-enamide Openeye Name: (E)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)-N-(2-methyl-4-nitro-phenyl)but-2-enamide CAS Name: (E)-3-(6-ethoxy-3-methyl-5-benzofuranyl)-N-(2-methyl-4-nitrophenyl)-2-butenamide IUPAC Name: (E)-3-(6-ethoxy-3-methyl-1-benzofuran-5-yl)-N-(2-methyl-4-nitrophenyl)but-2-enamide Traditional Name: (E)-3-(6-ethoxy-3-methyl-benzofuran-5-yl)-N-(2-methyl-4-nitro-phenyl)but-2-enamide Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=COC2=C1)C)C(=CC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CCOC1=C(C=C2C(=COC2=C1)C)/C(=C/C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)/C

InChI

InChI=1S/C22H22N2O5/c1-5-28-20-11-21-18(15(4)12-29-21)10-17(20)13(2)9-22(25)23-19-7-6-16(24(26)27)8-14(19)3/h6-12H,5H2,1-4H3,(H,23,25)/b13-9+