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Substance Name: Ammonium, (3-phenylacetoxy)phenyltrimethyl-, bromide
RN: 64049-72-5
InChIKey: JQVBVDFCXFLBPV-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-N-O2.Br

Molecular Weight

  • 350.254
 
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Names and Synonyms

Synonyms

  • (3-Phenylacetoxy)phenyltrimethylammonium bromide
  • Ro 2-2732

Systematic Name

  • Ammonium, (3-phenylacetoxy)phenyltrimethyl-, bromide

Registry Numbers

CAS Registry Number

  • 64049-72-5

System Generated Number

  • 0064049725

Molecular Formulas

Molecular Formula

  • C17-H20-N-O2.Br

Molecular Formula Fragments

  • Br
  • C17-H20-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C17H20NO2.BrH/c1-18(2,3)15-10-7-11-16(13-15)20-17(19)12-14-8-5-4-6-9-14;/h4-11,13H,12H2,1-3H3;1H/q+1;/p-1

InChIKey

JQVBVDFCXFLBPV-UHFFFAOYSA-M

Smiles

c1(cc(ccc1)[N+](C)(C)C)OC(Cc1ccccc1)=O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2500ug/kg (2.5mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION Journal of Pharmacology and Experimental Therapeutics. Vol. 99, Pg. 16, 1950.