2,3-dimethoxy-12-(methylamino)isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide

Systemtic Name: 2,3-dimethoxy-12-(methylamino)isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Openeye Name: 2,3-dimethoxy-12-(methylamino)isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide CAS Name: 2,3-dimethoxy-12-(methylamino)-9-isoquinolino[2,1-b]isoquinolin-7-iumol bromide IUPAC Name: 2,3-dimethoxy-12-(methylamino)isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Traditional Name: 2,3-dimethoxy-12-(methylamino)isoquinolin[2,1-b]isoquinolin-7-ium-9-ol bromide Formula: C20H19BrN2O3 MolecularWeight: 415.28046

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C2C=C3C4=CC(=C(C=C4C=C[N+]3=CC2=C(C=C1)O)OC)OC.[Br-]

Isomeric SMILES

CNC1=C2C=C3C4=CC(=C(C=C4C=C[N+]3=CC2=C(C=C1)O)OC)OC.[Br-]

InChI

InChI=1S/C20H18N2O3.BrH/c1-21-16-4-5-18(23)15-11-22-7-6-12-8-19(24-2)20(25-3)10-13(12)17(22)9-14(15)16;/h4-11,21H,1-3H3;1H