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Substance Name: Benzaldehyde, p-chloro-, O-(2-(4-phenethyl-1-piperazinyl)ethyl)oxime, dihydrochloride, (E)-
RN: 61734-21-2
InChIKey: ITJBIYNIMLNAEU-AHZNDLEBSA-N

Molecular Formula

  • C21-H26-Cl-N3-O.2Cl-H

Molecular Weight

  • 444.831
 
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Names and Synonyms

Synonym

  • trans-O-(2-(4-Phenethyl-1-piperazinyl)ethyl) 4-chlorobenzaldoxime dihydrochloride

Systematic Name

  • Benzaldehyde, p-chloro-, O-(2-(4-phenethyl-1-piperazinyl)ethyl)oxime, dihydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 61734-21-2

System Generated Number

  • 0061734212

Molecular Formulas

Molecular Formula

  • C21-H26-Cl-N3-O.2Cl-H

Molecular Formula Fragments

  • C21-H26-Cl-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26ClN3O.2ClH/c22-21-8-6-20(7-9-21)18-23-26-17-16-25-14-12-24(13-15-25)11-10-19-4-2-1-3-5-19;;/h1-9,18H,10-17H2;2*1H/b23-18+;;

InChIKey

ITJBIYNIMLNAEU-AHZNDLEBSA-N

Smiles

N1(CCN(CC1)CCO\N=C\c1ccc(cc1)Cl)CCc1ccccc1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 570mg/kg (570mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 369, 1976.