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Substance Name: 1-Propanesulfonic acid, 3-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)oxy)-, sodium salt (1:1)
RN: 85666-02-0
InChIKey: CETHOXLVCOKSIU-UHFFFAOYSA-M

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C23-H20-N2-O6-S.Na

Molecular Weight

  • 474.4671
 
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Names and Synonyms

  • 1-Propanesulfonic acid, 3-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)oxy)-, monosodium salt
  • 1-Propanesulfonic acid, 3-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)oxy)-, sodium salt (1:1)

Registry Numbers

CAS Registry Number

  • 85666-02-0

System Generated Number

  • 0085666020

Molecular Formulas

Molecular Formula

  • C23-H20-N2-O6-S.Na

Molecular Formula Fragments

  • C23-H20-N2-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C23H20N2O6S.Na/c24-21-18(31-11-6-12-32(28,29)30)13-17(25-14-7-2-1-3-8-14)19-20(21)23(27)16-10-5-4-9-15(16)22(19)26;/h1-5,7-10,13,25H,6,11-12,24H2,(H,28,29,30);/q;+1/p-1

InChIKey

CETHOXLVCOKSIU-UHFFFAOYSA-M

Smiles

c12c(C(=O)c3c(C1=O)cccc3)c(c(cc2Nc1ccccc1)OCCCS(=O)(=O)[O-])N.[Na+]