10-ethoxy-3-methoxy-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide

Systemtic Name: 10-ethoxy-3-methoxy-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Openeye Name: 10-ethoxy-3-methoxy-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide CAS Name: 10-ethoxy-3-methoxy-9-isoquinolino[2,1-b]isoquinolin-7-iumol bromide IUPAC Name: 10-ethoxy-3-methoxyisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Traditional Name: 10-ethoxy-3-methoxy-isoquinolin[2,1-b]isoquinolin-7-ium-9-ol bromide Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=C[N+]3=C(C=C2C=C1)C4=C(C=C3)C=C(C=C4)OC)O.[Br-]

Isomeric SMILES

CCOC1=C(C2=C[N+]3=C(C=C2C=C1)C4=C(C=C3)C=C(C=C4)OC)O.[Br-]

InChI

InChI=1S/C20H17NO3.BrH/c1-3-24-19-7-4-13-11-18-16-6-5-15(23-2)10-14(16)8-9-21(18)12-17(13)20(19)22;/h4-12H,3H2,1-2H3;1H