(E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)-N-(3-methylbutyl)but-2-enamide

Systemtic Name: (E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)-N-(3-methylbutyl)but-2-enamide Openeye Name: (E)-N-isopentyl-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-3-(6-methoxy-7-methyl-3-phenyl-5-benzofuranyl)-N-(3-methylbutyl)-2-butenamide IUPAC Name: (E)-3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)-N-(3-methylbutyl)but-2-enamide Traditional Name: (E)-N-isoamyl-3-(6-methoxy-7-methyl-3-phenyl-benzofuran-5-yl)but-2-enamide Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1OC)C(=CC(=O)NCCC(C)C)C)C(=CO2)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC(=C1OC)/C(=C/C(=O)NCCC(C)C)/C)C(=CO2)C3=CC=CC=C3

InChI

InChI=1S/C25H29NO3/c1-16(2)11-12-26-23(27)13-17(3)20-14-21-22(19-9-7-6-8-10-19)15-29-25(21)18(4)24(20)28-5/h6-10,13-16H,11-12H2,1-5H3,(H,26,27)/b17-13+