Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Disodium 4-(4-((3-(benzyl(3-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)azo)benzoyl)amino)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonate
RN: 93783-19-8
InChIKey: FXIMKHARKCPNAG-BHYOYDPTSA-L

Molecular Formula

  • C41-H35-N9-O9-S2.2Na

Molecular Weight

  • 905.8777
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 298-225-4

Systematic Name

  • Disodium 4-(4-((3-(benzyl(3-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)azo)benzoyl)amino)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonate

Registry Numbers

CAS Registry Number

  • 93783-19-8

System Generated Number

  • 0093783198

Molecular Formulas

Molecular Formula

  • C41-H35-N9-O9-S2.2Na

Molecular Formula Fragments

  • C41-H35-N9-O9-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C41H35N9O9S2.2Na/c1-25-12-13-31(43-45-38-27(3)47-50(41(38)53)33-16-20-35(21-17-33)61(57,58)59)23-36(25)48(24-28-8-5-4-6-9-28)39(51)29-10-7-11-30(22-29)42-44-37-26(2)46-49(40(37)52)32-14-18-34(19-15-32)60(54,55)56;;/h4-23,37-38H,24H2,1-3H3,(H,54,55,56)(H,57,58,59);;/q;2*+1/p-2/b44-42+,45-43+;;

InChIKey

FXIMKHARKCPNAG-BHYOYDPTSA-L

Smiles

Cc1ccc(cc1N(Cc2ccccc2)C(=O)c3cccc(c3)/N=N/C4C(=NN(C4=O)c5ccc(cc5)S(=O)(=O)[O-])C)/N=N/C6C(=NN(C6=O)c7ccc(cc7)S(=O)(=O)[O-])C.[Na+].[Na+]