1,2,3-trimethoxy-12-propyl-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide

Systemtic Name: 1,2,3-trimethoxy-12-propyl-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Openeye Name: 1,2,3-trimethoxy-12-propyl-isoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide CAS Name: 1,2,3-trimethoxy-12-propyl-9-isoquinolino[2,1-b]isoquinolin-7-iumol bromide IUPAC Name: 1,2,3-trimethoxy-12-propylisoquinolino[2,1-b]isoquinolin-7-ium-9-ol bromide Traditional Name: 1,2,3-trimethoxy-12-propyl-isoquinolin[2,1-b]isoquinolin-7-ium-9-ol bromide Formula: C23H24BrNO4 MolecularWeight: 458.34496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=C3C4=C(C(=C(C=C4C=C[N+]3=CC2=C(C=C1)O)OC)OC)OC.[Br-]

Isomeric SMILES

CCCC1=C2C=C3C4=C(C(=C(C=C4C=C[N+]3=CC2=C(C=C1)O)OC)OC)OC.[Br-]

InChI

InChI=1S/C23H23NO4.BrH/c1-5-6-14-7-8-19(25)17-13-24-10-9-15-11-20(26-2)22(27-3)23(28-4)21(15)18(24)12-16(14)17;/h7-13H,5-6H2,1-4H3;1H