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Substance Name: 2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-5-(diethylamino)pentyl ester, hydrochloride
RN: 119585-23-8
InChIKey: UOWCYGATDDZDMH-QOVZSLTQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-Br-Cl-N-O2.Cl-H

Molecular Weight

  • 515.316
 
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Names and Synonyms

Synonyms

  • Cinnamic acid, p-chloro-, 2-(4-bromophenyl)-5-(diethylamino)pentyl ester, hydrochloride
  • Pentanol, 2-(4-bromophenyl)-5-(diethylamino)-, chlorocinnamate hydrochloride
  • SR 44888 A

Systematic Name

  • 2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-5-(diethylamino)pentyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 119585-23-8

System Generated Number

  • 0119585238

Molecular Formulas

Molecular Formula

  • C24-H29-Br-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C24-H29-Br-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H29BrClNO2.ClH/c1-3-27(4-2)17-5-6-21(20-10-12-22(25)13-11-20)18-29-24(28)16-9-19-7-14-23(26)15-8-19;/h7-16,21H,3-6,17-18H2,1-2H3;1H/b16-9+;

InChIKey

UOWCYGATDDZDMH-QOVZSLTQSA-N

Smiles

CCN(CC)CCCC(COC(=O)/C=C/c1ccc(cc1)Cl)c2ccc(cc2)Br.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5089251,