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Substance Name: Benzoic acid, 2,4-dichloro-, 8-(diethylamino)-2-(1-naphthalenyl)octyl ester, hydrochloride
RN: 119585-25-0
InChIKey: WMDSMWHFBJOGEU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H35-Cl2-N-O2.Cl-H

Molecular Weight

  • 536.9674
 
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Names and Synonyms

Synonyms

  • 8-(Diethylamino)-2-(1-naphthalenyl)octyl 2,4-dichlorobenzoate hydrochloride
  • SR 45026 A

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 119585-25-0

System Generated Number

  • 0119585250

Molecular Formulas

Molecular Formula

  • C29-H35-Cl2-N-O2.Cl-H

Molecular Formula Fragments

  • C29-H35-Cl2-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H35Cl2NO2.ClH/c1-3-32(4-2)19-10-6-5-7-13-23(26-16-11-14-22-12-8-9-15-25(22)26)21-34-29(33)27-18-17-24(30)20-28(27)31;/h8-9,11-12,14-18,20,23H,3-7,10,13,19,21H2,1-2H3;1H

InChIKey

WMDSMWHFBJOGEU-UHFFFAOYSA-N

Smiles

CCN(CC)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,