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Substance Name: Pyridinium, 1-(2-((4-(2-(2-cyano-4-nitrophenyl)diazenyl)phenyl)ethylamino)ethyl)-, acetate (1:1)
RN: 72829-23-3
InChIKey: LKUAIRFCEGWJMJ-QREUMGABSA-M

Molecular Formula

  • C22-H21-N6-O2.C2-H3-O2

Molecular Weight

  • 460.492
 
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Names and Synonyms

Synonyms

  • EINECS 276-909-3
  • Pyridinium, 1-(2-((4-((4-nitro-2-cyanophenyl)azo)phenyl)ethylamino)ethyl)-, acetate

Systematic Names

  • 1-(2-((4-((2-Cyano-4-nitrophenyl)azo)phenyl)ethylamino)ethyl)pyridinium acetate
  • Pyridinium, 1-(2-((4-((2-cyano-4-nitrophenyl)azo)phenyl)ethylamino)ethyl)-, acetate
  • Pyridinium, 1-(2-((4-(2-(2-cyano-4-nitrophenyl)diazenyl)phenyl)ethylamino)ethyl)-, acetate (1:1)

Registry Numbers

CAS Registry Number

  • 72829-23-3

System Generated Number

  • 0072829233

Molecular Formulas

Molecular Formula

  • C22-H21-N6-O2.C2-H3-O2

Molecular Formula Fragments

  • C2-H3-O2
  • C22-H21-N6-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H21N6O2.C2H4O2/c1-2-27(15-14-26-12-4-3-5-13-26)20-8-6-19(7-9-20)24-25-22-11-10-21(28(29)30)16-18(22)17-23;1-2(3)4/h3-13,16H,2,14-15H2,1H3;1H3,(H,3,4)/q+1;/p-1/b25-24+;

InChIKey

LKUAIRFCEGWJMJ-QREUMGABSA-M

Smiles

c1[n+](cccc1)CCN(CC)c1ccc(cc1)\N=N\c1c(cc(cc1)[N+](=O)[O-])C#N.C(C)(=O)[O-]