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Substance Name: Pyridinium, 2-(2-(1-methylindol-3-yl)ethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
RN: 21199-38-2
InChIKey: AVSGYCMQUBOYGP-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-N3.2Br

Molecular Weight

  • 497.316
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 21199-38-2

System Generated Number

  • 0021199382

Molecular Formulas

Molecular Formula

  • C22-H31-N3.2Br

Molecular Formula Fragments

  • Br
  • C22-H31-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C22H31N3.2BrH/c1-23-18-19(21-11-5-6-12-22(21)23)13-14-20-10-7-8-15-24(20)16-9-17-25(2,3)4;;/h5-8,10-12,15,18H,9,13-14,16-17H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

AVSGYCMQUBOYGP-UHFFFAOYSA-L

Smiles

c1(cccc[n+]1CCC[N+](C)(C)C)CCc1cn(c2ccccc12)C.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 7600ug/kg (7.6mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 120, Pg. 438, 1957.