1,3,4,10-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide

Systemtic Name: 1,3,4,10-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Openeye Name: 1,3,4,10-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide CAS Name: 1,3,4,10-tetramethoxy-9-isoquinolino[2,1-b]isoquinolin-7-iumol bromide IUPAC Name: 1,3,4,10-tetramethoxyisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Traditional Name: 1,3,4,10-tetramethoxyisoquinolin[2,1-b]isoquinolin-7-ium-9-ol bromide Formula: C21H20BrNO5 MolecularWeight: 446.2912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=C(C=C3)C(=C(C=C4OC)OC)OC)O.[Br-]

Isomeric SMILES

COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=C(C=C3)C(=C(C=C4OC)OC)OC)O.[Br-]

InChI

InChI=1S/C21H19NO5.BrH/c1-24-16-6-5-12-9-15-19-13(7-8-22(15)11-14(12)20(16)23)21(27-4)18(26-3)10-17(19)25-2;/h5-11H,1-4H3;1H