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Substance Name: Ammonium, dimethyl((2,4-xylylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride
RN: 4169-39-5
InChIKey: QIABRHAKQAOTHO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H30-N3-O2.Cl

Molecular Weight

  • 403.951
 
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Names and Synonyms

Synonym

  • Dimethyl((2,4-xylylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)ammonium chloride

Systematic Name

  • Ammonium, dimethyl((2,4-xylylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride

Registry Numbers

CAS Registry Number

  • 4169-39-5

System Generated Number

  • 0004169395

Molecular Formulas

Molecular Formula

  • C22-H30-N3-O2.Cl

Molecular Formula Fragments

  • C22-H30-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3O2.ClH/c1-15-10-11-19(18(4)12-15)23-20(26)13-25(5,6)14-21(27)24-22-16(2)8-7-9-17(22)3;/h7-12H,13-14H2,1-6H3,(H-,23,24,26,27);1H

InChIKey

QIABRHAKQAOTHO-UHFFFAOYSA-N

Smiles

c1(NC(C[N+](CC(Nc2c(cc(C)cc2)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.