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Substance Name: 1H-Benzimidazolium, 5,6-dichloro-1-ethyl-2-(2-(phenylamino)ethenyl)-3-(3-sulfobutyl)-, inner salt
RN: 63148-86-7
InChIKey: FQBBPSDOXCQKMM-UHFFFAOYSA-N

Molecular Formula

  • C21-H23-Cl2-N3-O3-S

Molecular Weight

  • 468.403
 
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Names and Synonyms

Synonym

  • EINECS 263-938-1

Systematic Names

  • 1H-Benzimidazolium, 5,6-dichloro-1-ethyl-2-(2-(phenylamino)ethenyl)-3-(3-sulfobutyl)-, inner salt
  • 5,6-Dichloro-1-ethyl-2-(2-(phenylamino)vinyl)-3-(3-sulphonatobutyl)-1H-benzimidazolium

Registry Numbers

CAS Registry Number

  • 63148-86-7

System Generated Number

  • 0063148867

Structure Descriptors

InChI

1S/C21H23Cl2N3O3S/c1-3-25-19-13-17(22)18(23)14-20(19)26(12-10-15(2)30(27,28)29)21(25)9-11-24-16-7-5-4-6-8-16/h4-9,11,13-15H,3,10,12H2,1-2H3,(H,27,28,29)

InChIKey

FQBBPSDOXCQKMM-UHFFFAOYSA-N

Smiles

C(=C/Nc1ccccc1)\c1[n+](c2c(n1CC[C@@H](S(=O)(=O)[O-])C)cc(c(c2)Cl)Cl)CC