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Substance Name: Trisodium 4-amino-5-hydroxy-3-((4-((2-oxo-1-((phenylamino)carbonyl)propyl)azo)phenyl)azo)-6-((4-sulphonatophenyl)azo)naphthalene-2,7-disulphonate
RN: 85136-43-2
InChIKey: UAKFNVZZXUDUQS-AQOMXBTRSA-K

Molecular Formula

  • C32-H26-N8-O12-S3.3Na

Molecular Weight

  • 876.7457
 
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Names and Synonyms

Synonym

  • EINECS 285-768-7

Systematic Name

  • Trisodium 4-amino-5-hydroxy-3-((4-((2-oxo-1-((phenylamino)carbonyl)propyl)azo)phenyl)azo)-6-((4-sulphonatophenyl)azo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 85136-43-2

System Generated Number

  • 0085136432

Molecular Formulas

Molecular Formula

  • C32-H26-N8-O12-S3.3Na

Molecular Formula Fragments

  • C32-H26-N8-O12-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C32H26N8O12S3.3Na/c1-17(41)28(32(43)34-19-5-3-2-4-6-19)38-35-20-7-9-21(10-8-20)36-39-29-24(54(47,48)49)15-18-16-25(55(50,51)52)30(31(42)26(18)27(29)33)40-37-22-11-13-23(14-12-22)53(44,45)46;;;/h2-16,28,42H,33H2,1H3,(H,34,43)(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3/b38-35+,39-36+,40-37+;;;

InChIKey

UAKFNVZZXUDUQS-AQOMXBTRSA-K

Smiles

CC(=O)C(C(=O)Nc1ccccc1)/N=N/c2ccc(cc2)/N=N/c3c(cc4cc(c(c(c4c3N)O)/N=N/c5ccc(cc5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]