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Substance Name: Benzeneacetic acid, 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-, 2-(4-morpholinyl)ethyl ester, hydrochloride
RN: 134871-15-1
InChIKey: XKWCEIZDTFRFQV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Br2-N-O4.Cl-H

Molecular Weight

  • 535.6578
 
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Names and Synonyms

Synonym

  • 2-Morpholinoethyl 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneacetate hydrochloride

Systematic Name

  • Benzeneacetic acid, 4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-, 2-(4-morpholinyl)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 134871-15-1

System Generated Number

  • 0134871151

Molecular Formulas

Molecular Formula

  • C20-H21-Br2-N-O4.Cl-H

Molecular Formula Fragments

  • C20-H21-Br2-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21Br2NO4.ClH/c21-17-5-1-15(2-6-17)20(25,16-3-7-18(22)8-4-16)19(24)27-14-11-23-9-12-26-13-10-23;/h1-8,25H,9-14H2;1H

InChIKey

XKWCEIZDTFRFQV-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(c2ccc(cc2)Br)(C(=O)OCCN3CCOCC3)O)Br.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 210mg/kg (210mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 251, 1991.