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Substance Name: Benzoic acid, p-(2-methyl-4-piperidino-2-butenyl)-, (2-(diethylamino)ethyl) ester, dihydrochloride
RN: 22344-60-1
InChIKey: QNMSXBHHOLPRJV-KMLWPLPUSA-N

Molecular Formula

  • C23-H36-N2-O2.2Cl-H

Molecular Weight

  • 445.471
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 22344-60-1

System Generated Number

  • 0022344601

Molecular Formulas

Molecular Formula

  • C23-H36-N2-O2.2Cl-H

Molecular Formula Fragments

  • C23-H36-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H36N2O2.2ClH/c1-4-24(5-2)17-18-27-23(26)22-11-9-21(10-12-22)19-20(3)13-16-25-14-7-6-8-15-25;;/h9-13H,4-8,14-19H2,1-3H3;2*1H/b20-13+;;

InChIKey

QNMSXBHHOLPRJV-KMLWPLPUSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 197mg/kg (197mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 197mg/kg (197mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.