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Substance Name: Benzoic acid, 2,4-dichloro-, 2-(1-naphthalenyl)-4-(1-piperidinyl)butyl ester, hydrochloride
RN: 119585-04-5
InChIKey: KXOVZZXAFKSZON-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H27-Cl2-N-O2.Cl-H

Molecular Weight

  • 492.8712
 
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Names and Synonyms

Synonyms

  • 2-(1-Naphthalenyl)-4-(1-piperidinyl)butyl 2,4-dichlorobenzoate hydrochloride
  • SR 44152 A

Systematic Name

  • Benzoic acid, 2,4-dichloro-, 2-(1-naphthalenyl)-4-(1-piperidinyl)butyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 119585-04-5

System Generated Number

  • 0119585045

Molecular Formulas

Molecular Formula

  • C26-H27-Cl2-N-O2.Cl-H

Molecular Formula Fragments

  • C26-H27-Cl2-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H27Cl2NO2.ClH/c27-21-11-12-24(25(28)17-21)26(30)31-18-20(13-16-29-14-4-1-5-15-29)23-10-6-8-19-7-2-3-9-22(19)23;/h2-3,6-12,17,20H,1,4-5,13-16,18H2;1H

InChIKey

KXOVZZXAFKSZON-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)cccc2C(CCN3CCCCC3)COC(=O)c4ccc(cc4Cl)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,