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Substance Name: Quinolinium, 1-methyl-6-(alpha-((1-methylquinolinium-6-yl)carbamoyl)-p-anisamido)-, di-p-toluenesulfonate
RN: 34051-87-1
InChIKey: XTNHIBOYAODAQZ-ZFUDNRMFSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H26-N4-O3.2C7-H7-O3-S

Molecular Weight

  • 603.74
 
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Names and Synonyms

Synonyms

  • 1-Methyl-6-(p-(1-methyl-6-quinoliniocarbamoyl)phenoxyacetamido)quinolinium ditosylate
  • Quinolinium, 1-methyl-6-(p-(1-methyl-6-quinoliniocarbamoyl)phenoxyacetamido)-, ditosylate

Systematic Name

  • Quinolinium, 1-methyl-6-(alpha-((1-methylquinolinium-6-yl)carbamoyl)-p-anisamido)-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 34051-87-1

System Generated Number

  • 0034051871

Molecular Formulas

Molecular Formula

  • C29-H26-N4-O3.2C7-H7-O3-S

Molecular Formula Fragments

  • C29-H26-N4-O3
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C29H26N3O.C7H8O3S/c1-3-31-19-18-24(25-16-10-11-17-28(25)31)26(20-22-12-6-4-7-13-22)27-21-30(2)32(29(27)33)23-14-8-5-9-15-23;1-6-2-4-7(5-3-6)11(8,9)10/h4-21H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/b26-20+;

InChIKey

XTNHIBOYAODAQZ-ZFUDNRMFSA-M

Smiles

[n+]1(CC)ccc(C(\c2cn(n(c2=O)c2ccccc2)C)=C\c2ccccc2)c2ccccc12.c1(ccc(cc1)C)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 600ug/kg (0.6mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.