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Substance Name: 1H-Benzimidazolium, 5,6-dichloro-2-(3-(5,6-dichloro-1-ethyl-1,3-dihydro-3-(3-sulfobutyl)-2H-benzimidazol-2-ylidene)-1-propen-1-yl)-1-ethyl-3-(3-sulfobutyl)-, inner salt
RN: 3325-10-8
InChIKey: RJWQRNRJJGAMJG-UHFFFAOYSA-N

Molecular Formula

  • C29-H34-Cl4-N4-O6-S2

Molecular Weight

  • 740.5536
 
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Names and Synonyms

Synonyms

  • 5,6-Dichloro-2-(3-(5,6-dichloro-1-ethyl-3-(3-sulfobutyl)-1H-benzimidazol-2(3H)-ylidene)-1-propenyl)-1-ethyl-3-(3-sulfobutyl-1H-benzimidazolium hydroxide, inner salt
  • EINECS 222-041-5

Systematic Names

  • 1H-Benzimidazolium, 5,6-dichloro-2-(3-(5,6-dichloro-1-ethyl-1,3-dihydro-3-(3-sulfobutyl)-2H-benzimidazol-2-ylidene)-1-propen-1-yl)-1-ethyl-3-(3-sulfobutyl)-, inner salt
  • 1H-Benzimidazolium, 5,6-dichloro-2-(3-(5,6-dichloro-1-ethyl-1,3-dihydro-3-(3-sulfobutyl)-2H-benzimidazol-2-ylidene)-1-propenyl)-1-ethyl-3-(3-sulfobutyl)-, inner salt
  • Hydrogen 5,6-dichloro-2-(3-(5,6-dichloro-1-ethyl-1,3-dihydro-3-(3-sulphonatobutyl)-2H-benzimidazol-2-ylidene)propen-1-yl)-1-ethyl-3-(3-sulphonatobutyl)-1H-benzimidazolium

Registry Numbers

CAS Registry Number

  • 3325-10-8

Other Registry Numbers

  • 28496-42-6
  • 50886-18-5

System Generated Number

  • 0003325108

Structure Descriptors

InChI

1S/C29H34Cl4N4O6S2/c1-5-34-24-14-20(30)22(32)16-26(24)36(12-10-18(3)44(38,39)40)28(34)8-7-9-29-35(6-2)25-15-21(31)23(33)17-27(25)37(29)13-11-19(4)45(41,42)43/h7-9,14-19H,5-6,10-13H2,1-4H3,(H-,38,39,40,41,42,43)

InChIKey

RJWQRNRJJGAMJG-UHFFFAOYSA-N

Smiles

CCn1c2cc(c(cc2[n+](c1/C=C/C=C/3\N(c4cc(c(cc4N3CCC(C)S(=O)(=O)O)Cl)Cl)CC)CCC(C)S(=O)(=O)[O-])Cl)Cl