(E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(2-methyl-5-nitro-phenyl)but-2-enamide

Systemtic Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(2-methyl-5-nitro-phenyl)but-2-enamide Openeye Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-(2-methyl-5-nitro-phenyl)but-2-enamide CAS Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-N-(2-methyl-5-nitrophenyl)-2-butenamide IUPAC Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(2-methyl-5-nitrophenyl)but-2-enamide Traditional Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-(2-methyl-5-nitro-phenyl)but-2-enamide Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)/C(=C/C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C)/C)OC

InChI

InChI=1S/C27H24N2O5/c1-16-5-8-19(9-6-16)23-15-34-26-14-25(33-4)21(13-22(23)26)18(3)11-27(30)28-24-12-20(29(31)32)10-7-17(24)2/h5-15H,1-4H3,(H,28,30)/b18-11+