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Substance Name: Pyrrolidine, 3-(p-chloro-alpha-phenylbenzyloxy)-1-isobutyl-, hydrochloride
RN: 102446-20-8
InChIKey: KDDZJPQFSRCWHF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-Cl-N-O.Cl-H

Molecular Weight

  • 380.3563
 
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Names and Synonyms

Synonyms

  • 3-(p-Chloro-alpha-phenylbenzyloxy)-1-isobutylpyrrolidine hydrochloride
  • AHR 179

Systematic Name

  • Pyrrolidine, 3-(p-chloro-alpha-phenylbenzyloxy)-1-isobutyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 102446-20-8

System Generated Number

  • 0102446208

Molecular Formulas

Molecular Formula

  • C21-H26-Cl-N-O.Cl-H

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C21H26ClNO.ClH/c1-16(2)14-23-13-12-20(15-23)24-21(17-6-4-3-5-7-17)18-8-10-19(22)11-9-18;/h3-11,16,20-21H,12-15H2,1-2H3;1H

InChIKey

KDDZJPQFSRCWHF-UHFFFAOYSA-N

Smiles

C1[N@@](CC[C@@H]1O[C@@H](c1ccc(cc1)Cl)c1ccccc1)CC(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 1, Pg. 73, 1959.