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Substance Name: 1H-Benzotriazolium, 6-chloro-4-(2-(4-((2-cyanoethyl)ethylamino)phenyl)diazenyl)-1,3-dimethyl-, methyl sulfate (1:1)
RN: 36116-25-3
InChIKey: ZWYBMYDAKNKDJC-PGCQSHBKSA-M

Molecular Formula

  • C19-H21-Cl-N7.C-H3-O4-S

Molecular Weight

  • 494.982
 
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Names and Synonyms

Synonyms

  • 5-Chloro-7-((4-((2-cyanoethyl)ethylamino)phenyl)azo)-1,3-dimethyl-1H-benzotriazolium, methyl sulfate
  • EINECS 252-870-8

Systematic Names

  • 1H-Benzotriazolium, 6-chloro-4-((4-((2-cyanoethyl)ethylamino)phenyl)azo)-1,3-dimethyl-, methyl sulfate
  • 1H-Benzotriazolium, 6-chloro-4-(2-(4-((2-cyanoethyl)ethylamino)phenyl)diazenyl)-1,3-dimethyl-, methyl sulfate (1:1)
  • 5-Chloro-7-((4-((2-cyanoethyl)ethylamino)phenyl)azo)-1,3-dimethyl-1H-benzotriazolium methyl sulphate

Registry Numbers

CAS Registry Number

  • 36116-25-3

System Generated Number

  • 0036116253

Molecular Formulas

Molecular Formula

  • C19-H21-Cl-N7.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C19-H21-Cl-N7
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22ClN7.CH4O4S/c1-4-27(11-5-10-21)16-8-6-15(7-9-16)22-23-17-12-14(20)13-18-19(17)26(3)24-25(18)2;1-5-6(2,3)4/h6-9,12-13,24H,4-5,11H2,1-3H3;1H3,(H,2,3,4)/p-1/b23-22+;

InChIKey

ZWYBMYDAKNKDJC-PGCQSHBKSA-M

Smiles

N1(C)NN(C)c2c(\N=N\c3ccc(cc3)N(CC)CCC#N)cc(Cl)cc12.S(=O)(=O)(OC)[O-]