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Substance Name: Benzeneacetic acid, 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-, 3-(1-piperidinyl)propyl ester, hydrochloride
RN: 134871-14-0
InChIKey: MJELPYBCPNAPJE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-Br2-N-O3.Cl-H

Molecular Weight

  • 547.7124
 
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Names and Synonyms

  • Benzeneacetic acid, 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-, 3-(1-piperidinyl)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 134871-14-0

System Generated Number

  • 0134871140

Molecular Formulas

Molecular Formula

  • C22-H25-Br2-N-O3.Cl-H

Molecular Formula Fragments

  • C22-H25-Br2-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25Br2NO3.ClH/c23-19-9-5-17(6-10-19)22(27,18-7-11-20(24)12-8-18)21(26)28-16-4-15-25-13-2-1-3-14-25;/h5-12,27H,1-4,13-16H2;1H

InChIKey

MJELPYBCPNAPJE-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(c2ccc(cc2)Br)(C(=O)OCCCN3CCCCC3)O)Br.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 125mg/kg (125mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 251, 1991.