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Substance Name: Benzoic acid, 2,4-dichloro-, 8-(dimethylamino)-2-(1-naphthalenyl)octyl ester, hydrochloride
RN: 119585-24-9
InChIKey: WDDOCPPIOATFNX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H31-Cl2-N-O2.Cl-H

Molecular Weight

  • 508.9138
 
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Names and Synonyms

Synonyms

  • 8-(Dimethylamino)-2-(1-naphthalenyl)octyl 2,4-dichlorobenzoate hydrochloride
  • SR 44945 A

Systematic Name

  • Benzoic acid, 2,4-dichloro-, 8-(dimethylamino)-2-(1-naphthalenyl)octyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 119585-24-9

System Generated Number

  • 0119585249

Molecular Formulas

Molecular Formula

  • C27-H31-Cl2-N-O2.Cl-H

Molecular Formula Fragments

  • C27-H31-Cl2-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H31Cl2NO2.ClH/c1-30(2)17-8-4-3-5-11-21(24-14-9-12-20-10-6-7-13-23(20)24)19-32-27(31)25-16-15-22(28)18-26(25)29;/h6-7,9-10,12-16,18,21H,3-5,8,11,17,19H2,1-2H3;1H

InChIKey

WDDOCPPIOATFNX-UHFFFAOYSA-N

Smiles

CN(C)CCCCCCC(COC(=O)c1ccc(cc1Cl)Cl)c2cccc3c2cccc3.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,