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Substance Name: Piperidinium, 1-(2-hydroxyethyl)-1-nonyl-, bromide, o-(heptyloxy)carbanilate
RN: 69336-60-3
InChIKey: ZGSOYDKXDITAQD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H53-N2-O3.Br

Molecular Weight

  • 569.6637
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 69336-60-3

System Generated Number

  • 0069336603

Molecular Formulas

Molecular Formula

  • C30-H53-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C30-H53-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C30H52N2O3.BrH/c1-3-5-7-9-10-11-16-22-32(23-17-13-18-24-32)25-27-35-30(33)31-28-20-14-15-21-29(28)34-26-19-12-8-6-4-2;/h14-15,20-21H,3-13,16-19,22-27H2,1-2H3;1H

InChIKey

ZGSOYDKXDITAQD-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 600mg/kg (600mg/kg)   Cesko-Slovenska Farmacie. Vol. 27, Pg. 427, 1978.