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Substance Name: 2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride
RN: 119584-95-1
InChIKey: IMTHWNMNBWDEPN-RRAJOLSVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-Cl3-N-O2.Cl-H

Molecular Weight

  • 477.2565
 
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Names and Synonyms

Synonyms

  • 2-(3,4-Dichlorophenyl)-5-dimethylaminopentyl p-chlorocinnamate hydrochloride
  • Cinnamic acid, p-chloro-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride
  • SR 44429 A

Systematic Name

  • 2-Propenoic acid, 3-(4-chlorophenyl)-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 119584-95-1

System Generated Number

  • 0119584951

Molecular Formulas

Molecular Formula

  • C22-H24-Cl3-N-O2.Cl-H

Molecular Formula Fragments

  • C22-H24-Cl3-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24Cl3NO2.ClH/c1-26(2)13-3-4-18(17-8-11-20(24)21(25)14-17)15-28-22(27)12-7-16-5-9-19(23)10-6-16;/h5-12,14,18H,3-4,13,15H2,1-2H3;1H/b12-7+;

InChIKey

IMTHWNMNBWDEPN-RRAJOLSVSA-N

Smiles

CN(C)CCCC(COC(=O)/C=C/c1ccc(cc1)Cl)c2ccc(c(c2)Cl)Cl.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,