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Substance Name: Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride
RN: 1166-85-4
InChIKey: KQVQBPSOWVZVQD-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N-O3.Cl

Molecular Weight

  • 377.909
 
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Names and Synonyms

Synonyms

  • Benzilyloxyethyldiethylmethylammonium chloride
  • Diethyl(2-hydroxyethyl)methylammonium chloride, benzilate

Systematic Names

  • Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride
  • Ethanaminium, N,N-diethyl-2-((hydroxydiphenylacetyl)oxy)-N-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 1166-85-4

System Generated Number

  • 0001166854

Molecular Formulas

Molecular Formula

  • C21-H28-N-O3.Cl

Molecular Formula Fragments

  • C21-H28-N-O3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28NO3.ClH/c1-4-22(3,5-2)16-17-25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,24H,4-5,16-17H2,1-3H3;1H/q+1;/p-1

InChIKey

KQVQBPSOWVZVQD-UHFFFAOYSA-M

Smiles

C(c1ccccc1)(c1ccccc1)(C(OCC[N+](CC)(CC)C)=O)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 62500ug/kg (62.5mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE Journal of Pharmacology and Experimental Therapeutics. Vol. 85, Pg. 85, 1945.
mouse LD50 subcutaneous 130mg/kg (130mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE Journal of Pharmacology and Experimental Therapeutics. Vol. 85, Pg. 85, 1945.