(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-N-(3-nitrophenyl)but-2-enamide

Systemtic Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-N-(3-nitrophenyl)but-2-enamide Openeye Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-N-(3-nitrophenyl)but-2-enamide CAS Name: (E)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-N-(3-nitrophenyl)-2-butenamide IUPAC Name: (E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)-N-(3-nitrophenyl)but-2-enamide Traditional Name: (E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)-N-(3-nitrophenyl)but-2-enamide Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C(=C(C=C12)C(=CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C)OC)C

Isomeric SMILES

CC1=COC2=C(C(=C(C=C12)/C(=C/C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])/C)OC)C

InChI

InChI=1S/C21H20N2O5/c1-12(8-19(24)22-15-6-5-7-16(9-15)23(25)26)17-10-18-13(2)11-28-21(18)14(3)20(17)27-4/h5-11H,1-4H3,(H,22,24)/b12-8+