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

Systemtic Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]isoindoline-1,3-quinone Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C21H22N2O4/c1-26-18-11-13-7-9-22-17(16(13)12-19(18)27-2)8-10-23-20(24)14-5-3-4-6-15(14)21(23)25/h3-6,11-12,17,22H,7-10H2,1-2H3