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Substance Name: Bisdequalinium bromide
RN: 14075-14-0
UNII: 43I404P34T
InChIKey: QTDSECIVPCGVPG-BGRABRFLSA-N

Molecular Weight

  • 754.7342
 
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Names and Synonyms

Name of Substance

  • Bisdequalinium bromide

Synonyms

  • 5,34:18,23-Diethenodibenzo(b,R)(1,5,16,20)tetraazacyclotriacontine-23,34-diium, 6,7,8,9,10,11,12,13,14,15,16,17,24,25,26,27,28,29,30,31,32,33-docosahydro-35,37-dimethyl-, dibromide
  • Bisdequalinium bromide
  • Bisdequalinium dibromide
  • R-199
  • UNII-43I404P34T

Registry Numbers

CAS Registry Number

  • 14075-14-0

FDA UNII

  • 43I404P34T

System Generated Number

  • 0014075140

Structure Descriptors

InChI

1S/C40H56N4.2BrH/c1-33-31-37-35-23-15-17-25-39(35)43(33)29-21-13-9-5-6-10-14-22-30-44-34(2)32-38(36-24-16-18-26-40(36)44)42-28-20-12-8-4-3-7-11-19-27-41-37;;/h15-18,23-26,31-32H,3-14,19-22,27-30H2,1-2H3;2*1H/b41-37+,42-38+;;

InChIKey

QTDSECIVPCGVPG-BGRABRFLSA-N

Smiles

Cc1cc2c3ccccc3[n+]1CCCCCCCCCC[n+]4c(cc(c5c4cccc5)NCCCCCCCCCCN2)C.[Br-].[Br-]