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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 2,2'-(methylimino)diethanol
RN: 83763-80-8
InChIKey: IUTPLDWUOKPGAM-MKXWKNNCSA-N

Molecular Formula

  • C41-H28-N6-O15-S4.x-C5-H13-N-O2.x-Na

Molecular Weight

  • 1115.1159
 
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Names and Synonyms

Synonym

  • EINECS 280-768-3

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 83763-80-8

System Generated Number

  • 0083763808

Molecular Formulas

Molecular Formula

  • C41-H28-N6-O15-S4.x-C5-H13-N-O2.x-Na

Molecular Formula Fragments

  • C41-H28-N6-O15-S4
  • C5-H13-N-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C41H28N6O15S4.C5H13NO2.Na/c48-39-29-7-3-1-5-23(29)19-35(65(57,58)59)37(39)46-44-27-11-9-21-17-33(63(51,52)53)31(15-25(21)13-27)42-41(50)43-32-16-26-14-28(12-10-22(26)18-34(32)64(54,55)56)45-47-38-36(66(60,61)62)20-24-6-2-4-8-30(24)40(38)49;1-6(2-4-7)3-5-8;/h1-20,48-49H,(H2,42,43,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);7-8H,2-5H2,1H3;/q;;+1/b46-44+,47-45+;;

InChIKey

IUTPLDWUOKPGAM-MKXWKNNCSA-N

Smiles

CN(CCO)CCO.c1cc2c(c(c(c(c2)S(=O)(=O)O)/N=N/c3cc4c(cc(c(c4)NC(=O)Nc5c(cc6c(c5)cc(cc6)/N=N/c7c(c8c(cc7S(=O)(=O)O)cccc8)O)S(=O)(=O)O)S(=O)(=O)O)cc3)O)cc1.[Na+]