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Substance Name: Benzoic acid, 2,4-dichloro-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride
RN: 119585-11-4
InChIKey: SHABSCWKZNVUHW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl4-N-O2.Cl-H

Molecular Weight

  • 485.6638
 
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Names and Synonyms

Synonym

  • SR 44428 A

Systematic Name

  • Benzoic acid, 2,4-dichloro-, 2-(3,4-dichlorophenyl)-5-(dimethylamino)pentyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 119585-11-4

System Generated Number

  • 0119585114

Molecular Formulas

Molecular Formula

  • C20-H21-Cl4-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H21-Cl4-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21Cl4NO2.ClH/c1-25(2)9-3-4-14(13-5-8-17(22)19(24)10-13)12-27-20(26)16-7-6-15(21)11-18(16)23;/h5-8,10-11,14H,3-4,9,12H2,1-2H3;1H

InChIKey

SHABSCWKZNVUHW-UHFFFAOYSA-N

Smiles

CN(C)CCCC(COC(=O)c1ccc(cc1Cl)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,