2-[[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-4-methoxy-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-4-methoxy-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methoxy-phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-4-methoxyphenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methoxyphenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-methoxy-benzyl]isoindoline-1,3-quinone Formula: C28H26N2O6 MolecularWeight: 486.51584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC5=CC(=C(C=C5C4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCC5=CC(=C(C=C5C4)OC)OC

InChI

InChI=1S/C28H26N2O6/c1-34-23-9-8-17(15-30-27(32)20-6-4-5-7-21(20)28(30)33)12-22(23)26(31)29-11-10-18-13-24(35-2)25(36-3)14-19(18)16-29/h4-9,12-14H,10-11,15-16H2,1-3H3