2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)propyl]isoindoline-1,3-quinone Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CCCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CCCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C22H22N2O4/c1-27-19-12-14-9-10-23-18(17(14)13-20(19)28-2)8-5-11-24-21(25)15-6-3-4-7-16(15)22(24)26/h3-4,6-7,12-13H,5,8-11H2,1-2H3