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Substance Name: Acetic acid, phenoxy-, alpha-((diethylamino)methyl)-alpha-methylbenzyl ester, hydrochloride
RN: 34321-77-2
InChIKey: VNNCZKQFFPEJKZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Weight

  • 377.909
 
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Names and Synonyms

Synonym

  • Phenoxyacetic acid alpha-((diethylamino)methyl)-alpha-methylbenzyl ester hydrochloride

Systematic Name

  • Acetic acid, phenoxy-, alpha-((diethylamino)methyl)-alpha-methylbenzyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 34321-77-2

System Generated Number

  • 0034321772

Molecular Formulas

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27NO3.ClH/c1-4-22(5-2)17-21(3,18-12-8-6-9-13-18)25-20(23)16-24-19-14-10-7-11-15-19;/h6-15H,4-5,16-17H2,1-3H3;1H

InChIKey

VNNCZKQFFPEJKZ-UHFFFAOYSA-N

Smiles

c1([C@@](C[NH+](CC)CC)(OC(COc2ccccc2)=O)C)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15200ug/kg (15.2mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Farmakologiya i Toksikologiya Vol. 24, Pg. 706, 1961.