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Substance Name: Nonanoic acid, 2-cyclohexyl-3-hydroxy-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 95008-07-4
InChIKey: HCKUQDBBXSCFNV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H41-N-O3.Cl-H

Molecular Weight

  • 392.02
 
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Names and Synonyms

Synonym

  • 2-Cyclohexyl-3-hydroxynonanoic acid 2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • Nonanoic acid, 2-cyclohexyl-3-hydroxy-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 95008-07-4

System Generated Number

  • 0095008074

Molecular Formulas

Molecular Formula

  • C21-H41-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H41-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H41NO3.ClH/c1-4-7-8-12-15-19(23)20(18-13-10-9-11-14-18)21(24)25-17-16-22(5-2)6-3;/h18-20,23H,4-17H2,1-3H3;1H

InChIKey

HCKUQDBBXSCFNV-UHFFFAOYSA-N

Smiles

C1([C@@H](C(OCC[NH+](CC)CC)=O)[C@@H](CCCCCC)O)CCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8mg/kg (8mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 117, Pg. 331, 1956.