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Substance Name: Cyclohexaneglycolic acid, alpha-phenyl-, 1-ethyl-3-pyrrolidinyl ester, hydrochloride
RN: 101564-28-7
InChIKey: INHLKDFZWDSGPC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N-O3.Cl-H

Molecular Weight

  • 367.914
 
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Names and Synonyms

Synonyms

  • AHR 484
  • alpha-Phenylcyclohexaneglycolic acid 1-ethyl-3-pyrrolidinyl ester hydrochloride

Systematic Name

  • Cyclohexaneglycolic acid, alpha-phenyl-, 1-ethyl-3-pyrrolidinyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 101564-28-7

System Generated Number

  • 0101564287

Molecular Formulas

Molecular Formula

  • C20-H29-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H29-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H29NO3.ClH/c1-2-21-14-13-18(15-21)24-19(22)20(23,16-9-5-3-6-10-16)17-11-7-4-8-12-17;/h3,5-6,9-10,17-18,23H,2,4,7-8,11-15H2,1H3;1H

InChIKey

INHLKDFZWDSGPC-UHFFFAOYSA-N

Smiles

CCN1CCC(C1)OC(=O)C(c2ccccc2)(C3CCCCC3)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 149mg/kg (149mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 523, 1960.