(E)-N-(4-fluoranyl-3-nitro-phenyl)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-(4-fluoranyl-3-nitro-phenyl)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(4-fluoro-3-nitro-phenyl)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-(4-fluoro-3-nitrophenyl)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(4-fluoro-3-nitrophenyl)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(4-fluoro-3-nitro-phenyl)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enamide Formula: C21H19FN2O5 MolecularWeight: 398.384363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19FN2O5/c1-11(7-19(25)23-14-5-6-17(22)18(8-14)24(26)27)15-9-16-12(2)10-29-21(16)13(3)20(15)28-4/h5-10H,1-4H3,(H,23,25)/b11-7+