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

Systemtic Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(3-methylbutyl)but-2-enamide Openeye Name: (E)-N-isopentyl-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-enamide CAS Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-N-(3-methylbutyl)-2-butenamide IUPAC Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-(3-methylbutyl)but-2-enamide Traditional Name: (E)-N-isoamyl-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-enamide Formula: C25H29NO3 MolecularWeight: 391.50266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)NCCC(C)C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)/C(=C/C(=O)NCCC(C)C)/C)OC

InChI

InChI=1S/C25H29NO3/c1-16(2)10-11-26-25(27)12-18(4)20-13-21-22(19-8-6-17(3)7-9-19)15-29-24(21)14-23(20)28-5/h6-9,12-16H,10-11H2,1-5H3,(H,26,27)/b18-12+