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Substance Name: 2-Propanol, 1-(dimethylamino)-3-(2-(2-(3-methoxyphenyl)ethyl)phenoxy)-, hydrochloride
RN: 86819-17-2
InChIKey: YWZCEYHTWKUNMW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O3.Cl-H

Molecular Weight

  • 365.8982
 
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Names and Synonyms

Synonyms

  • 1-(Dimethylamino)-3-(2-(2-(3-methoxyphenyl)ethyl)phenoxy)-2-propanol hydrochloride
  • 2-((3-Dimethylamino-2-hydroxy)propoxy)-3'-methoxybibenzyl hydrochloride

Systematic Name

  • 2-Propanol, 1-(dimethylamino)-3-(2-(2-(3-methoxyphenyl)ethyl)phenoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 86819-17-2

Related Registry Number

  • 127003-40-1 (Parent)

System Generated Number

  • 0086819172

Molecular Formulas

Molecular Formula

  • C20-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27NO3.ClH/c1-21(2)14-18(22)15-24-20-10-5-4-8-17(20)12-11-16-7-6-9-19(13-16)23-3;/h4-10,13,18,22H,11-12,14-15H2,1-3H3;1H

InChIKey

YWZCEYHTWKUNMW-UHFFFAOYSA-N

Smiles

CN(C)CC(COc1ccccc1CCc2cccc(c2)OC)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 1818, 1990.
mouse LD50 oral 2gm/kg (2000mg/kg)   European Patent Application. Vol. #0072942,