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Substance Name: Benzoic acid, p-(4-piperidino-2-butenyl)-, (2-(diethylamino)ethyl) ester, dihydrochloride
RN: 22344-59-8
InChIKey: RUBJWZSIJWPEAJ-SWSRPJROSA-N

Molecular Formula

  • C22-H34-N2-O2.2Cl-H

Molecular Weight

  • 431.444
 
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Names and Synonyms

Synonym

  • p-(4-Piperidino-2-butenyl)benzoic acid (2-(diethylamino)ethyl) ester dihydrochloride

Systematic Name

  • Benzoic acid, p-(4-piperidino-2-butenyl)-, (2-(diethylamino)ethyl) ester, dihydrochloride

Registry Numbers

CAS Registry Number

  • 22344-59-8

System Generated Number

  • 0022344598

Molecular Formulas

Molecular Formula

  • C22-H34-N2-O2.2Cl-H

Molecular Formula Fragments

  • C22-H34-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H34N2O2.2ClH/c1-3-23(4-2)18-19-26-22(25)21-13-11-20(12-14-21)10-6-9-17-24-15-7-5-8-16-24;;/h6,9,11-14H,3-5,7-8,10,15-19H2,1-2H3;2*1H/b9-6+;;

InChIKey

RUBJWZSIJWPEAJ-SWSRPJROSA-N

Smiles

c1(ccc(C\C=C\C[NH+]2CCCCC2)cc1)C(OCC[NH+](CC)CC)=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 171mg/kg (171mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 171mg/kg (171mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.