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Substance Name: Benzenesulfonic acid, 2(or 5)-((4-amino-3-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-5(or 2)-methyl-, lithium salt (1:1)
RN: 69121-26-2
InChIKey: QPPOASJWLMCWAU-UHFFFAOYSA-M

Molecular Formula

  • C21-H15-Br-N2-O5-S.Li

Molecular Weight

  • 493.2616
 
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Names and Synonyms

Synonym

  • N-(4-Amino-3-bromo-1-anthraquinonyl)-p-toluidinesulfonic acid, monolithium salt

Systematic Names

  • Benzenesulfonic acid, 2(or 5)-((4-amino-3-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-5(or 2)-methyl-, lithium salt (1:1)
  • Benzenesulfonic acid, 2(or 5)-((4-amino-3-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-5(or 2)-methyl-, monolithium salt

Registry Numbers

CAS Registry Number

  • 69121-26-2

System Generated Number

  • 0069121262

Molecular Formulas

Molecular Formula

  • C21-H15-Br-N2-O5-S.Li

Molecular Formula Fragments

  • C21-H15-Br-N2-O5-S
  • COMPONENT
  • Li

Structure Descriptors

InChI

1S/C21H15BrN2O5S.Li/c1-10-6-7-14(16(8-10)30(27,28)29)24-15-9-13(22)19(23)18-17(15)20(25)11-4-2-3-5-12(11)21(18)26;/h2-9,24H,23H2,1H3,(H,27,28,29);/q;+1/p-1

InChIKey

QPPOASJWLMCWAU-UHFFFAOYSA-M

Smiles

[Li+].Cc1ccc(c(c1)S(=O)(=O)[O-])Nc2cc(c(c3c2C(=O)c4ccccc4C3=O)N)Br