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Substance Name: 6-Amino-1,2-dimethyl-7-((4-(phenoxysulphonyl)phenyl)azo)-1H-indazolium dihydrogen phosphate
RN: 94109-89-4
InChIKey: HEEKHMASSRIBFW-XMXXDQCKSA-N

Molecular Formula

  • C21-H20-N5-O3-S.H2-O4-P

Molecular Weight

  • 519.4728
 
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Names and Synonyms

Synonym

  • EINECS 302-529-5

Systematic Name

  • 6-Amino-1,2-dimethyl-7-((4-(phenoxysulphonyl)phenyl)azo)-1H-indazolium dihydrogen phosphate

Registry Numbers

CAS Registry Number

  • 94109-89-4

System Generated Number

  • 0094109894

Molecular Formulas

Molecular Formula

  • C21-H20-N5-O3-S.H2-O4-P

Molecular Formula Fragments

  • C21-H20-N5-O3-S
  • COMPONENT
  • H2-O4-P

Structure Descriptors

InChI

1S/C21H19N5O3S.H3O4P/c1-25-14-15-8-13-19(22)20(21(15)26(25)2)24-23-16-9-11-18(12-10-16)30(27,28)29-17-6-4-3-5-7-17;1-5(2,3)4/h3-14,22H,1-2H3;(H3,1,2,3,4)/b24-23+;

InChIKey

HEEKHMASSRIBFW-XMXXDQCKSA-N

Smiles

[n+]1(n(c2c(/N=N/c3ccc(S(=O)(=O)Oc4ccccc4)cc3)c(ccc2c1)N)C)C.P(=O)([O-])(O)O