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Substance Name: Quinolinium, 7,7'-(4,4'-biphenylylenebis(carbonylimino))bis(1-ethyl-, di-p-toluenesulfonate
RN: 18355-51-6
InChIKey: FMFMFXBMGQXJOX-UHFFFAOYSA-P

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C36-H32-N4-O2.2C7-H7-O3-S

Molecular Weight

  • 897.081
 
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Names and Synonyms

Synonyms

  • 7,7'-(4,4'-Biphenylylenebis(carbonylimino))bis(1-ethylquinolinium)di-p-toluenesulfonate
  • 7,7'-(p,p'-Biphenylylenebis(carbonylimino))bis(2-ethylquinolinium) ditosylate

Systematic Name

  • Quinolinium, 7,7'-(4,4'-biphenylylenebis(carbonylimino))bis(1-ethyl-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 18355-51-6

System Generated Number

  • 0018355516

Molecular Formulas

Molecular Formula

  • C36-H32-N4-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C36-H32-N4-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C36H30N4O2.2C7H8O3S/c1-3-39-21-5-7-27-17-19-31(23-33(27)39)37-35(41)29-13-9-25(10-14-29)26-11-15-30(16-12-26)36(42)38-32-20-18-28-8-6-22-40(4-2)34(28)24-32;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-24H,3-4H2,1-2H3;2*2-5H,1H3,(H,8,9,10)/p+2

InChIKey

FMFMFXBMGQXJOX-UHFFFAOYSA-P

Smiles

c1(ccc(C)cc1)S(=O)(=O)O.c1(ccc(cc1)C(=O)Nc1ccc2ccc[n+](c2c1)CC)c1ccc(cc1)C(=O)Nc1ccc2ccc[n+](c2c1)CC.c1(S(O)(=O)=O)ccc(C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 106mg/kg (106mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.