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Substance Name: Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, N-methyl-N-(p-tolyl)carbamate (ester)
RN: 66967-94-0
InChIKey: MPIQYPVPURRQQS-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-N3-O2.Br

Molecular Weight

  • 394.311
 
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Names and Synonyms

Synonym

  • Ro 2-2007

Systematic Name

  • Ammonium, ((3-hydroxy-2-pyridyl)methyl)trimethyl-, bromide, N-methyl-N-(p-tolyl)carbamate (ester)

Registry Numbers

CAS Registry Number

  • 66967-94-0

System Generated Number

  • 0066967940

Molecular Formulas

Molecular Formula

  • C18-H24-N3-O2.Br

Molecular Formula Fragments

  • Br
  • C18-H24-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C18H24N3O2.BrH/c1-14-8-10-15(11-9-14)20(2)18(22)23-17-7-6-12-19-16(17)13-21(3,4)5;/h6-12H,13H2,1-5H3;1H/q+1;/p-1

InChIKey

MPIQYPVPURRQQS-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3750ug/kg (3.75mg/kg)   Journal of the American Chemical Society. Vol. 74, Pg. 3323, 1952.