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Substance Name: 4-Piperidinol, 1-(2-(3,4-dimethoxyphenyl)ethyl)-, benzoate (ester), hydrochloride
RN: 134826-28-1
InChIKey: LYXUJZCAWIJHME-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Weight

  • 405.9192
 
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Names and Synonyms

Synonyms

  • 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-benzoylhydroxypiperidine hydrochloride
  • 1-(2-(3,4-Dimethoxyphenyl)ethyl)-4-piperidinol benzoate (ester) hydrochloride

Systematic Name

  • 4-Piperidinol, 1-(2-(3,4-dimethoxyphenyl)ethyl)-, benzoate (ester), hydrochloride

Registry Numbers

CAS Registry Number

  • 134826-28-1

System Generated Number

  • 0134826281

Molecular Formulas

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO4.ClH/c1-25-20-9-8-17(16-21(20)26-2)10-13-23-14-11-19(12-15-23)27-22(24)18-6-4-3-5-7-18;/h3-9,16,19H,10-15H2,1-2H3;1H

InChIKey

LYXUJZCAWIJHME-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)CCN2CCC(CC2)OC(=O)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 243, 1991.