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Substance Name: Pyridinium, 1-(2-((2-((4-methylphenyl)amino)phenyl)amino)-2-oxoethyl)-, chloride
RN: 129178-31-0
InChIKey: PIYALCIWCVUZPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-N3-O.Cl

Molecular Weight

  • 353.851
 
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Names and Synonyms

Synonym

  • 1-(2-((2-((4-Methylphenyl)amino)phenyl)amino)-2-oxoethyl)pyridinium chloride

Systematic Name

  • Pyridinium, 1-(2-((2-((4-methylphenyl)amino)phenyl)amino)-2-oxoethyl)-, chloride

Registry Numbers

CAS Registry Number

  • 129178-31-0

System Generated Number

  • 0129178310

Molecular Formulas

Molecular Formula

  • C20-H20-N3-O.Cl

Molecular Formula Fragments

  • C20-H20-N3-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C20H19N3O.ClH/c1-16-9-11-17(12-10-16)21-18-7-3-4-8-19(18)22-20(24)15-23-13-5-2-6-14-23;/h2-14,21H,15H2,1H3;1H

InChIKey

PIYALCIWCVUZPB-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)Nc2ccccc2NC(=O)C[n+]3ccccc3.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #5055469,