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Substance Name: Ammonium, dimethyl(3-hydroxyphenyl)(p-nitrobenzyl)-, chloride
RN: 66941-42-2
InChIKey: QXWOSXXRWXDETA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-N2-O3.Cl

Molecular Weight

  • 308.763
 
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Names and Synonyms

Synonyms

  • Dimethyl(3-hydroxyphenyl)(p-nitrobenzyl)ammonium chloride
  • Ro 2-4357

Systematic Name

  • Ammonium, dimethyl(3-hydroxyphenyl)(p-nitrobenzyl)-, chloride

Registry Numbers

CAS Registry Number

  • 66941-42-2

System Generated Number

  • 0066941422

Molecular Formulas

Molecular Formula

  • C15-H17-N2-O3.Cl

Molecular Formula Fragments

  • C15-H17-N2-O3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C15H16N2O3.ClH/c1-17(2,14-4-3-5-15(18)10-14)11-12-6-8-13(9-7-12)16(19)20;/h3-10H,11H2,1-2H3;1H

InChIKey

QXWOSXXRWXDETA-UHFFFAOYSA-N

Smiles

c1(C[N+](c2cc(ccc2)O)(C)C)ccc([N+](=O)[O-])cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 17mg/kg (17mg/kg)   Medicinal Chemistry, A Series of Reviews. Vol. 3, Pg. 326, 1956.