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Substance Name: 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide
RN: 63731-84-0
InChIKey: CWJNZABCORLUPT-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N3.2Br

Molecular Weight

  • 471.278
 
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Names and Synonyms

Synonyms

  • Ammonium, (5-(1-methyl-9H-pyrido(3,4-b)indolinio)pentyl)trimethyl-, dibromide
  • IN 216

Systematic Name

  • 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 63731-84-0

System Generated Number

  • 0063731840

Molecular Formulas

Molecular Formula

  • C20-H29-N3.2Br

Molecular Formula Fragments

  • Br
  • C20-H29-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C20H28N3.2BrH/c1-16-20-17-10-6-7-11-18(17)21-19(20)12-14-22(16)13-8-5-9-15-23(2,3)4;;/h6-7,10-12,14H,5,8-9,13,15H2,1-4H3;2*1H/q+1;;/p-1

InChIKey

CWJNZABCORLUPT-UHFFFAOYSA-M

Smiles

c12c([nH]c3c2cccc3)cc[n+](c1C)CCCCC[N+](C)(C)C.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2500ug/kg (2.5mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Journal of Pharmacology and Experimental Therapeutics. Vol. 114, Pg. 306, 1955.