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Substance Name: 3-Hydroxymethyl-N-methylpiperidyl (4-chlorophenoxy)acetate
RN: 80842-07-5
InChIKey: JHJOZTMFSDMYCE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-Cl-N-O3.Cl-H

Molecular Weight

  • 334.241
 
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Names and Synonyms

Name of Substance

  • 3-Hydroxymethyl-N-methylpiperidyl (4-chlorophenoxy)acetate

Synonyms

  • (p-Chlorophenoxy)acetic acid (1-methyl-3-piperidyl)methyl ester hydrochloride
  • 3-Hydroxymethyl-N-methylpiperidine 4-chlorophenoxyacetate hydrochloride
  • Chlorhydrate (chloro-4 phenoxyacetate) de N-methyl hydroxymethyl-3 piperidine
  • Chlorhydrate (chloro-4 phenoxyacetate) de N-methyl hydroxymethyl-3 piperidine [French]

Systematic Names

  • Acetic acid, (4-chlorophenoxy)-, (2S-cis)-
  • Acetic acid, (p-chlorophenoxy)-, (1-methyl-3-piperidyl)methyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 80842-07-5

System Generated Number

  • 0080842075

Molecular Formulas

Molecular Formula

  • C15-H20-Cl-N-O3.Cl-H

Molecular Formula Fragments

  • C15-H20-Cl-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H20ClNO3.ClH/c1-17-8-2-3-12(9-17)10-20-15(18)11-19-14-6-4-13(16)5-7-14;/h4-7,12H,2-3,8-11H2,1H3;1H

InChIKey

JHJOZTMFSDMYCE-UHFFFAOYSA-N

Smiles

C([C@@H]1C[N@@H+](CCC1)C)OC(COc1ccc(Cl)cc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2250mg/kg (2250mg/kg)   Comptes Rendus de l'Academie des Sciences, Serie 3: Sciences de la Vie. Vol. 299, Pg. 347, 1984.