6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide

Systemtic Name: 6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide Openeye Name: 2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide CAS Name: 6,7-dimethoxy-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium bromide IUPAC Name: 2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide Traditional Name: 2-benzyl-6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2-ium bromide Formula: C24H24BrNO2 MolecularWeight: 438.35686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[N+](=C2C3=CC=CC=C3)CC4=CC=CC=C4)OC.[Br-]

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[N+](=C2C3=CC=CC=C3)CC4=CC=CC=C4)OC.[Br-]

InChI

InChI=1S/C24H24NO2.BrH/c1-26-22-15-20-13-14-25(17-18-9-5-3-6-10-18)24(19-11-7-4-8-12-19)21(20)16-23(22)27-2;/h3-12,15-16H,13-14,17H2,1-2H3;1H/q+1;/p-1