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Substance Name: Benzenesulfonic acid, (3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)butyl)-, sodium salt (1:1)
RN: 70224-88-3
InChIKey: ILPBZLYLCPDREW-UHFFFAOYSA-M

Molecular Formula

  • C27-H28-N2-O5-S.Na

Molecular Weight

  • 514.575
 
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Names and Synonyms

Synonyms

  • Benzenesulfonic acid, (3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)butyl)-, monosodium salt
  • EINECS 274-459-2

Systematic Names

  • Benzenesulfonic acid, (3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)butyl)-, monosodium salt
  • Benzenesulfonic acid, (3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)butyl)-, sodium salt (1:1)
  • Sodium (3-((9,10-dihydro-4-(isopropylamino)-9,10-dioxo-1-anthryl)amino)butyl)benzenesulphonate

Registry Numbers

CAS Registry Number

  • 70224-88-3

System Generated Number

  • 0070224883

Molecular Formulas

Molecular Formula

  • C27-H28-N2-O5-S.Na

Molecular Formula Fragments

  • C27-H28-N2-O5-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C27H28N2O5S.Na/c1-16(2)28-21-14-15-22(25-24(21)26(30)19-9-5-6-10-20(19)27(25)31)29-17(3)12-13-18-8-4-7-11-23(18)35(32,33)34;/h4-11,14-17,28-29H,12-13H2,1-3H3,(H,32,33,34);/q;+1/p-1

InChIKey

ILPBZLYLCPDREW-UHFFFAOYSA-M

Smiles

[Na+].c1(c(cccc1)CC[C@@H](C)Nc1ccc(c2C(c3ccccc3C(c12)=O)=O)NC(C)C)S(=O)(=O)[O-]