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Substance Name: Quinolinium, 1-propyl-6-(p-((1-propylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate
RN: 14242-18-3
InChIKey: WBMHAOUFLAPEKQ-UMVVUDSKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H34-N4-O2.2C7-H7-O3-S

Molecular Weight

  • 873.059
 
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Names and Synonyms

Synonyms

  • 6,6'-(Styrene-alpha,p-diylbis(carbonylimino))bis(1-propylquinolinium)ditosylate
  • Quinolinium, 6,6'-(styrene-alpha,p-diylbis(carbonylimino))bis(1-propyl-, ditosylate

Systematic Name

  • Quinolinium, 1-propyl-6-(p-((1-propylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 14242-18-3

System Generated Number

  • 0014242183

Molecular Formulas

Molecular Formula

  • C34-H34-N4-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C34-H34-N4-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C34H32N4O2.2C7H8O3S/c1-3-19-37-21-5-7-26-14-16-29(23-31(26)37)35-33(39)18-11-25-9-12-28(13-10-25)34(40)36-30-17-15-27-8-6-22-38(20-4-2)32(27)24-30;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-18,21-24H,3-4,19-20H2,1-2H3;2*2-5H,1H3,(H,8,9,10)/b18-11+;;

InChIKey

WBMHAOUFLAPEKQ-UMVVUDSKSA-N

Smiles

c1(S(=O)(=O)[O-])ccc(C)cc1.[n+]1(c2c(ccc1)ccc(c2)NC(=O)c1ccc(\C=C\C(Nc2ccc3ccc[n+](CCC)c3c2)=O)cc1)CCC.c1(ccc(cc1)C)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 20mg/kg (20mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.