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

Systemtic Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]isoindoline-1,3-quinone Formula: C21H23N2O4+ MolecularWeight: 367.41832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

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