(E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-en-1-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)C(=CC(=O)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)/C(=C/C(=O)N4CCC5=CC=CC=C5C4)/C

InChI

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