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Substance Name: Piperidinium, 1-(2-hydroxyethyl)-1-octyl-, bromide, o-(heptyloxy)carbanilate
RN: 69336-59-0
InChIKey: GNSQJPPYNSJXHN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H51-N2-O3.Br

Molecular Weight

  • 555.6369
 
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Names and Synonyms

Synonyms

  • 1-(2-Hydroxyethyl)-1-octylpiperidinium bromide o-(heptyloxy)carbanilate
  • Piperidinium, 1-(2-((((2-(heptyloxy)phenyl)amino)carbonyl)oxy)ethyl)-1-octyl-, bromide

Systematic Name

  • Piperidinium, 1-(2-hydroxyethyl)-1-octyl-, bromide, o-(heptyloxy)carbanilate

Registry Numbers

CAS Registry Number

  • 69336-59-0

System Generated Number

  • 0069336590

Molecular Formulas

Molecular Formula

  • C29-H51-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C29-H51-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C29H50N2O3.BrH/c1-3-5-7-9-10-15-21-31(22-16-12-17-23-31)24-26-34-29(32)30-27-19-13-14-20-28(27)33-25-18-11-8-6-4-2;/h13-14,19-20H,3-12,15-18,21-26H2,1-2H3;1H

InChIKey

GNSQJPPYNSJXHN-UHFFFAOYSA-N

Smiles

CCCCCCCC[N+]1(CCCCC1)CCOC(=O)Nc2ccccc2OCCCCCCC.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 300mg/kg (300mg/kg)   Cesko-Slovenska Farmacie. Vol. 27, Pg. 427, 1978.