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Substance Name: Ethanaminium, 2-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)thio)-N,N,N-trimethyl-, methyl sulfate (1:1)
RN: 18559-08-5
InChIKey: HRMHEMRQUBSLFJ-UHFFFAOYSA-N

Molecular Formula

  • C25-H26-N3-O2-S.C-H3-O4-S

Molecular Weight

  • 543.662
 
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Names and Synonyms

  • Ethanaminium, 2-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)thio)-N,N,N-trimethyl-, methyl sulfate
  • Ethanaminium, 2-((1-amino-9,10-dihydro-9,10-dioxo-4-(phenylamino)-2-anthracenyl)thio)-N,N,N-trimethyl-, methyl sulfate (1:1)

Registry Numbers

CAS Registry Number

  • 18559-08-5

System Generated Number

  • 0018559085

Molecular Formulas

Molecular Formula

  • C25-H26-N3-O2-S.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C25-H26-N3-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C25H25N3O2S.CH4O4S/c1-28(2,3)13-14-31-20-15-19(27-16-9-5-4-6-10-16)21-22(23(20)26)25(30)18-12-8-7-11-17(18)24(21)29;1-5-6(2,3)4/h4-12,15H,13-14H2,1-3H3,(H2-,26,27,29,30);1H3,(H,2,3,4)

InChIKey

HRMHEMRQUBSLFJ-UHFFFAOYSA-N

Smiles

[N+](CCSc1c(c2C(c3ccccc3C(c2c(Nc2ccccc2)c1)=O)=O)N)(C)(C)C.S(=O)(=O)(OC)[O-]