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Substance Name: Dihydrogen 2-(4-((1-((o-anisidino)carbonyl)-2-oxopropyl)azo)-3-sulphonatophenyl)-4,7-disulphonato-1H-naphtho(1,2-d)triazolium, sodium salt, compound with 2,2',2''-nitrilotris(ethanol)
RN: 83763-76-2
InChIKey: HRKJRUIYIRSZPV-MHAWFHQYSA-L

Molecular Formula

  • C27-H22-N6-O12-S3.x-C6-H15-N-O3.x-Na

Molecular Weight

  • 911.8515
 
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Names and Synonyms

Synonym

  • EINECS 280-764-1

Systematic Name

  • Dihydrogen 2-(4-((1-((o-anisidino)carbonyl)-2-oxopropyl)azo)-3-sulphonatophenyl)-4,7-disulphonato-1H-naphtho(1,2-d)triazolium, sodium salt, compound with 2,2',2''-nitrilotris(ethanol)

Registry Numbers

CAS Registry Number

  • 83763-76-2

System Generated Number

  • 0083763762

Molecular Formulas

Molecular Formula

  • C27-H22-N6-O12-S3.x-C6-H15-N-O3.x-Na

Molecular Formula Fragments

  • C27-H22-N6-O12-S3
  • C6-H15-N-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C27H22N6O12S3.C6H15NO3.2Na/c1-14(34)24(27(35)28-19-5-3-4-6-21(19)45-2)30-29-20-10-7-16(13-22(20)47(39,40)41)33-31-25-18-9-8-17(46(36,37)38)11-15(18)12-23(26(25)32-33)48(42,43)44;8-4-1-7(2-5-9)3-6-10;;/h3-13,24H,1-2H3,(H4,28,35,36,37,38,39,40,41,42,43,44);8-10H,1-6H2;;/q;;2*+1/p-2/b30-29+;;;

InChIKey

HRKJRUIYIRSZPV-MHAWFHQYSA-L

Smiles

CC(=O)C(C(=O)Nc1ccccc1OC)/N=N/c2ccc(cc2S(=O)(=O)[O-])[n+]3[nH]c4c5ccc(cc5cc(c4n3)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+].[Na+]