Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate
RN: 18520-38-2
InChIKey: KVQSUDLRDCHXGR-KMLWPLPUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H38-N4-O2.2C7-H7-O3-S

Molecular Weight

  • 901.113
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

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

Systematic Name

  • Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 18520-38-2

System Generated Number

  • 0018520382

Molecular Formulas

Molecular Formula

  • C36-H38-N4-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C36-H38-N4-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C36H36N4O2.2C7H8O3S/c1-3-5-21-39-23-7-9-29-25-31(16-18-33(29)39)37-35(41)20-13-27-11-14-28(15-12-27)36(42)38-32-17-19-34-30(26-32)10-8-24-40(34)22-6-4-2;2*1-6-2-4-7(5-3-6)11(8,9)10/h7-20,23-26H,3-6,21-22H2,1-2H3;2*2-5H,1H3,(H,8,9,10)/b20-13+;;

InChIKey

KVQSUDLRDCHXGR-KMLWPLPUSA-N

Smiles

c1(ccc(C)cc1)S(=O)(=O)[O-].[n+]1(cccc2cc(ccc12)NC(\C=C\c1ccc(cc1)C(=O)Nc1cc2ccc[n+](c2cc1)CCCC)=O)CCCC.c1(S([O-])(=O)=O)ccc(C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 25mg/kg (25mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.