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Substance Name: Isoxazole, 3-phenyl-5-(3-piperidinopropyl)-, hydrochloride
RN: 1090-85-3
InChIKey: MLRHTHUQODBLDB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H22-N2-O.Cl-H

Molecular Weight

  • 306.835
 
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Names and Synonyms

Synonym

  • 3-Phenyl-5-(3-piperidinopropyl)isoxazole hydrochloride

Systematic Name

  • Isoxazole, 3-phenyl-5-(3-piperidinopropyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1090-85-3

System Generated Number

  • 0001090853

Molecular Formulas

Molecular Formula

  • C17-H22-N2-O.Cl-H

Molecular Formula Fragments

  • C17-H22-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H22N2O.ClH/c1-3-8-15(9-4-1)17-14-16(20-18-17)10-7-13-19-11-5-2-6-12-19;/h1,3-4,8-9,14H,2,5-7,10-13H2;1H

InChIKey

MLRHTHUQODBLDB-UHFFFAOYSA-N

Smiles

c1(c2ccccc2)cc(CCC[NH+]2CCCCC2)on1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 186mg/kg (186mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 10, Pg. 411, 1967.