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Substance Name: 1-(2-((4-((2,6-Dichloro-4-nitrophenyl)azo)-m-tolyl)ethylamino)ethyl)pyridinium acetate
RN: 84051-85-4
InChIKey: LBHDILWMGJVBDB-BTKVJIOYSA-M

Molecular Formula

  • C22-H22-Cl2-N5-O2.C2-H3-O2

Molecular Weight

  • 518.3985
 
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Names and Synonyms

Synonym

  • EINECS 281-874-2

Systematic Name

  • 1-(2-((4-((2,6-Dichloro-4-nitrophenyl)azo)-m-tolyl)ethylamino)ethyl)pyridinium acetate

Registry Numbers

CAS Registry Number

  • 84051-85-4

System Generated Number

  • 0084051854

Molecular Formulas

Molecular Formula

  • C22-H22-Cl2-N5-O2.C2-H3-O2

Molecular Formula Fragments

  • C2-H3-O2
  • C22-H22-Cl2-N5-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H22Cl2N5O2.C2H4O2/c1-3-28(12-11-27-9-5-4-6-10-27)17-7-8-21(16(2)13-17)25-26-22-19(23)14-18(29(30)31)15-20(22)24;1-2(3)4/h4-10,13-15H,3,11-12H2,1-2H3;1H3,(H,3,4)/q+1;/p-1/b26-25+;

InChIKey

LBHDILWMGJVBDB-BTKVJIOYSA-M

Smiles

CCN(CC[n+]1ccccc1)c2ccc(c(c2)C)/N=N/c3c(cc(cc3Cl)[N+](=O)[O-])Cl.CC(=O)[O-]