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Substance Name: 7,7'-(Carbonyldiimino)bis(4-hydroxy-3-((6-sulpho-2-naphthyl)azo)naphthalene-2-sulphonic) acid, sodium salt, compound with 2-aminoethanol
RN: 85959-62-2
InChIKey: AYNOXJWVSCANRR-MKXWKNNCSA-N

Molecular Formula

  • C41-H28-N6-O15-S4.x-C2-H7-N-O.x-Na

Molecular Weight

  • 1057.0365
 
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Names and Synonyms

Synonym

  • EINECS 289-057-2

Systematic Name

  • 7,7'-(Carbonyldiimino)bis(4-hydroxy-3-((6-sulpho-2-naphthyl)azo)naphthalene-2-sulphonic) acid, sodium salt, compound with 2-aminoethanol

Registry Numbers

CAS Registry Number

  • 85959-62-2

System Generated Number

  • 0085959622

Molecular Formulas

Molecular Formula

  • C41-H28-N6-O15-S4.x-C2-H7-N-O.x-Na

Molecular Formula Fragments

  • C2-H7-N-O
  • C41-H28-N6-O15-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C41H28N6O15S4.C2H7NO.Na/c48-39-33-11-7-27(15-25(33)19-35(65(57,58)59)37(39)46-44-29-5-1-23-17-31(63(51,52)53)9-3-21(23)13-29)42-41(50)43-28-8-12-34-26(16-28)20-36(66(60,61)62)38(40(34)49)47-45-30-6-2-24-18-32(64(54,55)56)10-4-22(24)14-30;3-1-2-4;/h1-20,48-49H,(H2,42,43,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);4H,1-3H2;/q;;+1/b46-44+,47-45+;;

InChIKey

AYNOXJWVSCANRR-MKXWKNNCSA-N

Smiles

[Na+].NCCO.Oc1c(N=Nc2ccc3cc(ccc3c2)S(=O)(=O)O)c(cc4cc(NC(=O)Nc5ccc6c(O)c(N=Nc7ccc8cc(ccc8c7)S(=O)(=O)O)c(cc6c5)S(=O)(=O)O)ccc14)S(=O)(=O)O