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Substance Name: 6-Chloro-4-((4-((2-cyanoethyl)ethylamino)phenyl)azo)-1,3-dimethyl-1H-benzimidazolium acetate
RN: 96446-15-0
InChIKey: FZNXUDWBPCSEIR-XMXXDQCKSA-M

Molecular Formula

  • C20-H22-Cl-N6.C2-H3-O2

Molecular Weight

  • 440.9325
 
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Names and Synonyms

Synonym

  • EINECS 306-142-2

Systematic Name

  • 6-Chloro-4-((4-((2-cyanoethyl)ethylamino)phenyl)azo)-1,3-dimethyl-1H-benzimidazolium acetate

Registry Numbers

CAS Registry Number

  • 96446-15-0

System Generated Number

  • 0096446150

Molecular Formulas

Molecular Formula

  • C20-H22-Cl-N6.C2-H3-O2

Molecular Formula Fragments

  • C2-H3-O2
  • C20-H22-Cl-N6
  • COMPONENT

Structure Descriptors

InChI

1S/C20H22ClN6.C2H4O2/c1-4-27(11-5-10-22)17-8-6-16(7-9-17)23-24-18-12-15(21)13-19-20(18)26(3)14-25(19)2;1-2(3)4/h6-9,12-14H,4-5,11H2,1-3H3;1H3,(H,3,4)/q+1;/p-1/b24-23+;

InChIKey

FZNXUDWBPCSEIR-XMXXDQCKSA-M

Smiles

c1n(c2c(c(cc(c2)Cl)\N=N\c2ccc(cc2)N(CC)CCC#N)[n+]1C)C.C(C)(=O)[O-]