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Substance Name: Piperidinium, 1-(2-hydroxyethyl)-1-heptyl-, bromide, o-(pentyloxy)carbanilate
RN: 70939-57-0
InChIKey: FCGGLLYPTJSPAV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H45-N2-O3.Br

Molecular Weight

  • 513.5565
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 70939-57-0

System Generated Number

  • 0070939570

Molecular Formulas

Molecular Formula

  • C26-H45-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C26-H45-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C26H44N2O3.BrH/c1-3-5-7-8-12-18-28(19-13-9-14-20-28)21-23-31-26(29)27-24-16-10-11-17-25(24)30-22-15-6-4-2;/h10-11,16-17H,3-9,12-15,18-23H2,1-2H3;1H

InChIKey

FCGGLLYPTJSPAV-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 100mg/kg (100mg/kg)   Cesko-Slovenska Farmacie. Vol. 27, Pg. 427, 1978.