6,7-dimethoxy-2-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC3=CC=CN3C4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CC3=CC=CN3C4=CN=CC=C4)OC

InChI

InChI=1S/C21H23N3O2/c1-25-20-11-16-7-10-23(14-17(16)12-21(20)26-2)15-19-6-4-9-24(19)18-5-3-8-22-13-18/h3-6,8-9,11-13H,7,10,14-15H2,1-2H3/p+1