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Substance Name: Isoxazole, 3-(p-chlorophenyl)-5-(2-piperidinoethyl)-, hydrochloride
RN: 5243-94-7
InChIKey: MTQYKNDRCDUTEC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-Cl-N2-O.Cl-H

Molecular Weight

  • 327.253
 
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Names and Synonyms

Synonym

  • 3-(p-Chlorophenyl)-5-(2-piperidinoethyl)isoxazole hydrochloride

Systematic Name

  • Isoxazole, 3-(p-chlorophenyl)-5-(2-piperidinoethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 5243-94-7

System Generated Number

  • 0005243947

Molecular Formulas

Molecular Formula

  • C16-H19-Cl-N2-O.Cl-H

Molecular Formula Fragments

  • C16-H19-Cl-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H19ClN2O.ClH/c17-14-6-4-13(5-7-14)16-12-15(20-18-16)8-11-19-9-2-1-3-10-19;/h4-7,12H,1-3,8-11H2;1H

InChIKey

MTQYKNDRCDUTEC-UHFFFAOYSA-N

Smiles

c1(c2ccc(Cl)cc2)cc(CC[NH+]2CCCCC2)on1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 297mg/kg (297mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 10, Pg. 411, 1967.