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Substance Name: Pyridinium, 3-indol-2-yl-1-(3-(trimethylammonio)propyl)-, dibromide
RN: 21199-46-2
InChIKey: KIKJXWYDHGRXIN-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H25-N3.2Br

Molecular Weight

  • 455.236
 
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Names and Synonyms

Synonym

  • 3-Indol-2-yl-1-(3-(trimethylammonio)propyl)pyridinium dibromide

Systematic Name

  • Pyridinium, 3-indol-2-yl-1-(3-(trimethylammonio)propyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 21199-46-2

System Generated Number

  • 0021199462

Molecular Formulas

Molecular Formula

  • C19-H25-N3.2Br

Molecular Formula Fragments

  • Br
  • C19-H25-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C19H25N3.2BrH/c1-22(2,3)13-7-12-21-11-6-9-17(15-21)19-14-16-8-4-5-10-18(16)20-19;;/h4-6,8-11,14-15,20H,7,12-13H2,1-3H3;2*1H/q+2;;/p-2

InChIKey

KIKJXWYDHGRXIN-UHFFFAOYSA-L

Smiles

c1c(ccc[n+]1CCC[N+](C)(C)C)c1[nH]c2ccccc2c1.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 33mg/kg (33mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 120, Pg. 438, 1957.