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Substance Name: Piperidinium, 1-decyl-1-(2-hydroxyethyl)-, bromide, o-(pentyloxy)carbanilate
RN: 70939-60-5
InChIKey: KRDLSMUMSPCSHB-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-Decyl-1-(2-hydroxyethyl)piperidinium bromide o-(pentyloxy)carbanilate
  • Piperidinium, 1-decyl-1-(2-((((2-(pentyloxy)phenyl)amino)carbonyl)oxy)ethyl)-, bromide

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 70939-60-5

System Generated Number

  • 0070939605

Molecular Formulas

Molecular Formula

  • C29-H51-N2-O3.Br

Molecular Formula Fragments

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

Structure Descriptors

InChI

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

InChIKey

KRDLSMUMSPCSHB-UHFFFAOYSA-N

Smiles

CCCCCCCCCC[N+]1(CCCCC1)CCOC(=O)Nc2ccccc2OCCCCC.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 400mg/kg (400mg/kg)   Cesko-Slovenska Farmacie. Vol. 27, Pg. 427, 1978.