3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethyl-azanium bromide

Systemtic Name: 3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethyl-azanium bromide Openeye Name: 3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethyl-ammonium bromide CAS Name: 3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethylammonium bromide IUPAC Name: 3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethylazanium bromide Traditional Name: 3-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)propyl-trimethyl-ammonium bromide Formula: C17H28BrN2O2+ MolecularWeight: 372.32042

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC[N+]1=CC2=CC(=C(C=C2CC1)OC)OC.[Br-]

Isomeric SMILES

C[N+](C)(C)CCC[N+]1=CC2=CC(=C(C=C2CC1)OC)OC.[Br-]

InChI

InChI=1S/C17H28N2O2.BrH/c1-19(2,3)10-6-8-18-9-7-14-11-16(20-4)17(21-5)12-15(14)13-18;/h11-13H,6-10H2,1-5H3;1H/q+2;/p-1