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

Systemtic Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-phenethyl-but-2-enamide Openeye Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-phenethyl-but-2-enamide CAS Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-N-phenethyl-2-butenamide IUPAC Name: (E)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]-N-phenethylbut-2-enamide Traditional Name: (E)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]-N-phenethyl-but-2-enamide Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)NCCC4=CC=CC=C4)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)/C(=C/C(=O)NCCC4=CC=CC=C4)/C)OC

InChI

InChI=1S/C28H27NO3/c1-19-9-11-22(12-10-19)25-18-32-27-17-26(31-3)23(16-24(25)27)20(2)15-28(30)29-14-13-21-7-5-4-6-8-21/h4-12,15-18H,13-14H2,1-3H3,(H,29,30)/b20-15+