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Substance Name: Cyclohexaneacetic acid, 1-hydroxy-3-methyl-alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 110331-53-8
InChIKey: NHKALYTUASZDPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H33-N-O3.Cl-H

Molecular Weight

  • 383.9566
 
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Names and Synonyms

Synonym

  • 1-Hydroxy-3-methyl-alpha-phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester HCl

Systematic Name

  • Cyclohexaneacetic acid, 1-hydroxy-3-methyl-alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 110331-53-8

System Generated Number

  • 0110331538

Molecular Formulas

Molecular Formula

  • C21-H33-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H33-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H33NO3.ClH/c1-4-22(5-2)14-15-25-20(23)19(18-11-7-6-8-12-18)21(24)13-9-10-17(3)16-21;/h6-8,11-12,17,19,24H,4-5,9-10,13-16H2,1-3H3;1H

InChIKey

NHKALYTUASZDPB-UHFFFAOYSA-N

Smiles

CCN(CC)CCOC(=O)C(c1ccccc1)C2(CCCC(C2)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 38mg/kg (38mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 117, Pg. 331, 1956.