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Substance Name: Carbanilic acid, m-(pentyloxy)-, 1-butyl-4-piperidyl ester, hydrochloride
RN: 105405-74-1
InChIKey: QMECIPWRGUPTNI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H34-N2-O3.Cl-H

Molecular Weight

  • 398.971
 
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Names and Synonyms

Synonyms

  • Carbamic acid, (3-(pentyloxy)phenyl)-, 1-butyl-4-piperidinyl ester, monohydrochloride
  • m-(Pentyloxy)carbanilic acid 1-butyl-4-piperidyl ester hydrochloride
  • PAK 4435

Systematic Name

  • Carbanilic acid, m-(pentyloxy)-, 1-butyl-4-piperidyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 105405-74-1

System Generated Number

  • 0105405741

Molecular Formulas

Molecular Formula

  • C21-H34-N2-O3.Cl-H

Molecular Formula Fragments

  • C21-H34-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H34N2O3.ClH/c1-3-5-7-16-25-20-10-8-9-18(17-20)22-21(24)26-19-11-14-23(15-12-19)13-6-4-2;/h8-10,17,19H,3-7,11-16H2,1-2H3,(H,22,24);1H

InChIKey

QMECIPWRGUPTNI-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)OCCCCC)NC(OC1CC[NH+](CCCC)CC1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 600mg/kg (600mg/kg)   Cesko-Slovenska Farmacie. Vol. 35, Pg. 299, 1986.