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Substance Name: Tetrasodium 5,5'-(ethylenebis((3-sulphonato-4,1-phenylene)-ONN-azoxy))bis(8-(phenylazo)naphthalene-2-sulphonate)
RN: 93982-66-2
InChIKey: PCKDGCQWSYMQJI-DCMFRQAMSA-J

Molecular Formula

  • C46-H32-N8-O14-S4.4Na

Molecular Weight

  • 1139.009
 
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Names and Synonyms

Synonym

  • EINECS 301-255-3

Systematic Name

  • Tetrasodium 5,5'-(ethylenebis((3-sulphonato-4,1-phenylene)-ONN-azoxy))bis(8-(phenylazo)naphthalene-2-sulphonate)

Registry Numbers

CAS Registry Number

  • 93982-66-2

System Generated Number

  • 0093982662

Molecular Formulas

Molecular Formula

  • C46-H32-N8-O14-S4.4Na

Molecular Formula Fragments

  • C46-H32-N8-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C46H34N8O14S4.4Na/c55-53(51-43-23-21-41(49-47-31-7-3-1-4-8-31)39-27-35(69(57,58)59)17-19-37(39)43)33-15-13-29(45(25-33)71(63,64)65)11-12-30-14-16-34(26-46(30)72(66,67)68)54(56)52-44-24-22-42(50-48-32-9-5-2-6-10-32)40-28-36(70(60,61)62)18-20-38(40)44;;;;/h1-10,13-28H,11-12H2,(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68);;;;/q;4*+1/p-4/b49-47+,50-48+,53-51+,54-52+;;;;

InChIKey

PCKDGCQWSYMQJI-DCMFRQAMSA-J

Smiles

S(=O)(=O)(c1cc(/[N+](=N\c2c3c(cc(S(=O)(=O)[O-])cc3)c(/N=N/c3ccccc3)cc2)[O-])ccc1CCc1c(S(=O)(=O)[O-])cc(/[N+](=N\c2c3c(cc(S(=O)(=O)[O-])cc3)c(/N=N/c3ccccc3)cc2)[O-])cc1)[O-].[Na+].[Na+].[Na+].[Na+]