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Substance Name: Isoxazole, 3-(p-chlorophenyl)-5-(piperidinomethyl)-, hydrochloride
RN: 5500-11-8
InChIKey: QBJARSHSMWQTGG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-Cl-N2-O.Cl-H

Molecular Weight

  • 313.226
 
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Names and Synonyms

Synonym

  • 3-(p-Chlorophenyl)-5-(piperidinomethyl)isoxazole hydrochloride

Systematic Name

  • Isoxazole, 3-(p-chlorophenyl)-5-(piperidinomethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 5500-11-8

System Generated Number

  • 0005500118

Molecular Formulas

Molecular Formula

  • C15-H17-Cl-N2-O.Cl-H

Molecular Formula Fragments

  • C15-H17-Cl-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H17ClN2O.ClH/c16-13-6-4-12(5-7-13)15-10-14(19-17-15)11-18-8-2-1-3-9-18;/h4-7,10H,1-3,8-9,11H2;1H

InChIKey

QBJARSHSMWQTGG-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 768mg/kg (768mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 10, Pg. 411, 1967.