1,2,3,4,4alpha-beta,5,6,7,8,8alpha-beta-Decahydro-7-alpha-Hydroxy-2,2-Dimethyl-Isoquinolium Bromide p-Anisate
[CAS# 28798-20-1]

Identification

• Name: 1,2,3,4,4alpha-beta,5,6,7,8,8alpha-beta-Decahydro-7-alpha-Hydroxy-2,2-Dimethyl-Isoquinolium Bromide p-Anisate
• Synonyms: 4-Methoxybenzoic Acid [(4As,7S,8As)-2,2-Dimethyl-3,4,4A,5,6,7,8,8A-Octahydro-1H-Isoquinolin-2-Ium-7-Yl] Ester Bromide; Isoquinolium, 1,2,3,4,4A-Beta,5,6,7,8,8A-Beta-Decahydro-7-Alpha-Hydroxy-2,2-Dimethyl-, Bromide, P-Anisate
• Molecular Formula: C₁₉H₂₈BrNO₃
• Molecular Weight: 398.34
• CAS Registry Number: 28798-20-1
• SMILES: [C@H]12CC[N+](C[C@H]1C[C@H](CC2)OC(C3=CC=C(C=C3)OC)=O)(C)C.[Br-]
• InChI: 1S/C19H28NO3.BrH/c1-20(2)11-10-14-4-9-18(12-16(14)13-20)23-19(21)15-5-7-17(22-3)8-6-15;/h5-8,14,16,18H,4,9-13H2,1-3H3;1H/q+1;/p-1/t14-,16+,18-;/m0./s1
• InChIKey: OBDXBGSEHJBESP-OGLDAAHQSA-M