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

Systemtic Name: (E)-N-(4-fluoranyl-3-nitro-phenyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(4-fluoro-3-nitro-phenyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-(4-fluoro-3-nitrophenyl)-3-(6-methoxy-2,3,7-trimethyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(4-fluoro-3-nitrophenyl)-3-(6-methoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(4-fluoro-3-nitro-phenyl)-3-(6-methoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enamide Formula: C22H21FN2O5 MolecularWeight: 412.410943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C(=C(C=C12)C(=CC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C)OC)C)C

Isomeric SMILES

CC1=C(OC2=C(C(=C(C=C12)/C(=C/C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])/C)OC)C)C

InChI

InChI=1S/C22H21FN2O5/c1-11(8-20(26)24-15-6-7-18(23)19(9-15)25(27)28)16-10-17-12(2)14(4)30-22(17)13(3)21(16)29-5/h6-10H,1-5H3,(H,24,26)/b11-8+