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Substance Name: Ammonium, dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride
RN: 4169-33-9
InChIKey: YSKADTNXEBAWKW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N3-O2.Cl

Molecular Weight

  • 389.924
 
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Names and Synonyms

Synonym

  • Dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)ammonium chloride

Systematic Name

  • Ammonium, dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride

Registry Numbers

CAS Registry Number

  • 4169-33-9

System Generated Number

  • 0004169339

Molecular Formulas

Molecular Formula

  • C21-H28-N3-O2.Cl

Molecular Formula Fragments

  • C21-H28-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N3O2.ClH/c1-15-9-6-7-12-18(15)22-19(25)13-24(4,5)14-20(26)23-21-16(2)10-8-11-17(21)3;/h6-12H,13-14H2,1-5H3,(H-,22,23,25,26);1H

InChIKey

YSKADTNXEBAWKW-UHFFFAOYSA-N

Smiles

c1(NC(C[N+](CC(Nc2c(cccc2)C)=O)(C)C)=O)c(cccc1C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intravenous 5mg/kg (5mg/kg) CARDIAC: CARDIOMYOPATHY INCLUDING INFARCTION Acta Pharmaceutica Suecica. Vol. 2, Pg. 219, 1965.