(E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(4-methylphenyl)-5-benzofuranyl]-2-buten-1-one IUPAC Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(4-methylphenyl)-1-benzofuran-5-yl]but-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[6-methoxy-3-(p-tolyl)benzofuran-5-yl]but-2-en-1-one Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)C(=CC(=O)N4CCC5=CC=CC=C5C4)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC3=CC(=C(C=C32)/C(=C/C(=O)N4CCC5=CC=CC=C5C4)/C)OC

InChI

InChI=1S/C29H27NO3/c1-19-8-10-22(11-9-19)26-18-33-28-16-27(32-3)24(15-25(26)28)20(2)14-29(31)30-13-12-21-6-4-5-7-23(21)17-30/h4-11,14-16,18H,12-13,17H2,1-3H3/b20-14+