3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium bromide

Systemtic Name: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium bromide Openeye Name: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium bromide CAS Name: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium bromide IUPAC Name: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium bromide Traditional Name: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinolin-7-ium bromide Formula: C20H24BrNO2 MolecularWeight: 390.31406

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCC3=C(C1CC4=C(C2)C=C(C=C4)OC)C=CC(=C3)OC.[Br-]

Isomeric SMILES

C[N+]12CCC3=C(C1CC4=C(C2)C=C(C=C4)OC)C=CC(=C3)OC.[Br-]

InChI

InChI=1S/C20H24NO2.BrH/c1-21-9-8-15-10-18(23-3)6-7-19(15)20(21)12-14-4-5-17(22-2)11-16(14)13-21;/h4-7,10-11,20H,8-9,12-13H2,1-3H3;1H/q+1;/p-1