4-[Hydroxy(diphenyl)methyl]-1-{2-[(²H₅)phenylmethoxy]ethyl}-1-azoniabicyclo[2.2.2]octane bromide

More details:

• Systematic name

  4-[Hydroxy(diphenyl)methyl]-1-{2-[(~2~H_5_)phenylmethoxy]ethyl}-1-azoniabicyclo[2.2.2]octane bromide

• SMILES

  C1([2H])=C([2H])C([2H])=C(C([2H])=C1[2H])COCC[N+]23CCC(CC2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O.[Br-] [2H]c1c(c(c(c(c1[2H])[2H])COCC[N+]23CCC(CC2)(CC3)C(c4ccccc4)(c5ccccc5)O)[2H])[2H].[Br-]

• Std. InChi

  InChI=1S/C29H34NO2.BrH/c31-29(26-12-6-2-7-13-26,27-14-8-3-9-15-27)28-16-19-30(20-17-28,21-18-28)22-23-32-24-25-10-4-1-5-11-25;/h1-15,31H,16-24H2;1H/q+1;/p-1/i1D,4D,5D,10D,11D;

• Std. InChIKey

  PEJHHXHHNGORMP-XBIAMBGESA-M

• Cite this record

  CSID:58784967, http://www.chemspider.com/Chemical-Structure.58784967.html (accessed 07:41, Apr 23, 2024)