2-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]isoindole-1,3-dione Openeye Name: 2-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]isoindoline-1,3-dione CAS Name: 2-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]isoindole-1,3-dione Traditional Name: 2-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]isoindoline-1,3-quinone Formula: C28H24N2O6 MolecularWeight: 484.49996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3N4C(=O)C5=CC=CC=C5C4=O)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3N4C(=O)C5=CC=CC=C5C4=O)OC)OC)OC

InChI

InChI=1S/C28H24N2O6/c1-33-23-12-16-9-10-29-21(20(16)14-25(23)35-3)11-17-13-24(34-2)26(36-4)15-22(17)30-27(31)18-7-5-6-8-19(18)28(30)32/h5-10,12-15H,11H2,1-4H3