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Substance Name: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((methyl((4-methylphenyl)sulfonyl)amino)methyl)phenyl)amino)-9,10-dioxo-, sodium salt (1:1)
RN: 72828-82-1
InChIKey: JOXJJQNGIBRWJT-UHFFFAOYSA-M

Molecular Formula

  • C29-H25-N3-O7-S2.Na

Molecular Weight

  • 613.645
 
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Names and Synonyms

Synonyms

  • 1-Amino-4-(((4-(N-((4-methylphenyl)sulfonyl)-N-methyl-amino)methyl)phenyl)amino)anthraquinone-2-sulfonic acid, sodium salt
  • EINECS 276-889-6

Systematic Names

  • 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((methyl((4-methylphenyl)sulfonyl)amino)methyl)phenyl)amino)-9,10-dioxo-, monosodium salt
  • 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((methyl((4-methylphenyl)sulfonyl)amino)methyl)phenyl)amino)-9,10-dioxo-, sodium salt (1:1)
  • Sodium 1-amino-9,10-dihydro-4-((4-((methyl((4-methylphenyl)sulphonyl)amino)methyl)phenyl)amino)-9,10-dioxoanthracene-2-sulphonate

Registry Numbers

CAS Registry Number

  • 72828-82-1

System Generated Number

  • 0072828821

Molecular Formulas

Molecular Formula

  • C29-H25-N3-O7-S2.Na

Molecular Formula Fragments

  • C29-H25-N3-O7-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H25N3O7S2.Na/c1-17-7-13-20(14-8-17)40(35,36)32(2)16-18-9-11-19(12-10-18)31-23-15-24(41(37,38)39)27(30)26-25(23)28(33)21-5-3-4-6-22(21)29(26)34;/h3-15,31H,16,30H2,1-2H3,(H,37,38,39);/q;+1/p-1

InChIKey

JOXJJQNGIBRWJT-UHFFFAOYSA-M

Smiles

[Na+].c1(c(cc(c2C(c3ccccc3C(c12)=O)=O)Nc1ccc(cc1)C[N@@](S(=O)(=O)c1ccc(cc1)C)C)S(=O)(=O)[O-])N