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Substance Name: Pyridinium, 4-(2-inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
RN: 21199-29-1
InChIKey: GZJIADQNSYALBN-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H30-N2.2Br

Molecular Weight

  • 482.301
 
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Names and Synonyms

Synonym

  • 4-(2-Inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromide

Systematic Name

  • Pyridinium, 4-(2-inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 21199-29-1

System Generated Number

  • 0021199291

Molecular Formulas

Molecular Formula

  • C22-H30-N2.2Br

Molecular Formula Fragments

  • Br
  • C22-H30-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H30N2.2BrH/c1-24(2,3)18-6-15-23-16-13-19(14-17-23)9-10-21-12-11-20-7-4-5-8-22(20)21;;/h4-5,7-8,11-14,16-17,21H,6,9-10,15,18H2,1-3H3;2*1H/q+2;;/p-2

InChIKey

GZJIADQNSYALBN-UHFFFAOYSA-L

Smiles

c1cc(cc[n+]1CCC[N+](C)(C)C)CC[C@@H]1C=Cc2ccccc12.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8200ug/kg (8.2mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 120, Pg. 438, 1957.