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Substance Name: Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, (p-bromophenyl)methylcarbamate
RN: 69766-50-3
InChIKey: KXYBFKJEJAYODT-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H21-Br-N3-O2.Br

Molecular Weight

  • 459.18
 
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Names and Synonyms

Synonyms

  • ((3-Hydroxy-2-pyridyl)methyl)trimethylammonium bromide (p-bromophenyl)methylcarbamate
  • Ro 2-1976

Systematic Name

  • Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, (p-bromophenyl)methylcarbamate

Registry Numbers

CAS Registry Number

  • 69766-50-3

System Generated Number

  • 0069766503

Molecular Formulas

Molecular Formula

  • C17-H21-Br-N3-O2.Br

Molecular Formula Fragments

  • Br
  • C17-H21-Br-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21BrN3O2.BrH/c1-20(14-9-7-13(18)8-10-14)17(22)23-16-6-5-11-19-15(16)12-21(2,3)4;/h5-11H,12H2,1-4H3;1H/q+1;/p-1

InChIKey

KXYBFKJEJAYODT-UHFFFAOYSA-M

Smiles

c1(c(C[N+](C)(C)C)nccc1)OC(N(c1ccc(Br)cc1)C)=O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1800ug/kg (1.8mg/kg)   Journal of the American Chemical Society. Vol. 74, Pg. 3323, 1952.