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Substance Name: Piperidinium, 1-allyl-1-(2-hydroxyethyl)-, bromide, o-(pentyloxy)carbanilate
RN: 70939-61-6
InChIKey: WATHQOUMOZZJHU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H35-N2-O3.Br

Molecular Weight

  • 455.4335
 
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Names and Synonyms

Synonyms

  • 1-Allyl-1-(2-hydroxyethyl)piperidinium bromide o-(pentyloxy)carbanilate
  • Piperidinium, 1-(2-((((2-(pentyloxy)phenyl)amino)carbonyl)oxy)ethyl)-1-(2-propenyl)-, bromide

Systematic Name

  • Piperidinium, 1-allyl-1-(2-hydroxyethyl)-, bromide, o-(pentyloxy)carbanilate

Registry Numbers

CAS Registry Number

  • 70939-61-6

System Generated Number

  • 0070939616

Molecular Formulas

Molecular Formula

  • C22-H35-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C22-H35-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C22H34N2O3.BrH/c1-3-5-11-18-26-21-13-8-7-12-20(21)23-22(25)27-19-17-24(14-4-2)15-9-6-10-16-24;/h4,7-8,12-13H,2-3,5-6,9-11,14-19H2,1H3;1H

InChIKey

WATHQOUMOZZJHU-UHFFFAOYSA-N

Smiles

CCCCCOc1ccccc1NC(=O)OCC[N+]2(CCCCC2)CC=C.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 50mg/kg (50mg/kg)   Cesko-Slovenska Farmacie. Vol. 27, Pg. 427, 1978.