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Substance Name: 3-((9,10-Dihydro-4-(methylamino)-9,10-dioxo-1-anthryl)aminopropyl)trimethylammonium acetate
RN: 85187-76-4
InChIKey: BLJWXGLBHJPREZ-UHFFFAOYSA-N

Molecular Formula

  • C21-H26-N3-O2.C2-H3-O2

Molecular Weight

  • 411.4991
 
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Names and Synonyms

Synonym

  • EINECS 286-164-6

Systematic Name

  • 3-((9,10-Dihydro-4-(methylamino)-9,10-dioxo-1-anthryl)aminopropyl)trimethylammonium acetate

Registry Numbers

CAS Registry Number

  • 85187-76-4

System Generated Number

  • 0085187764

Molecular Formulas

Molecular Formula

  • C21-H26-N3-O2.C2-H3-O2

Molecular Formula Fragments

  • C2-H3-O2
  • C21-H26-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N3O2.C2H4O2/c1-22-16-10-11-17(23-12-7-13-24(2,3)4)19-18(16)20(25)14-8-5-6-9-15(14)21(19)26;1-2(3)4/h5-6,8-11H,7,12-13H2,1-4H3,(H-,22,23,25,26);1H3,(H,3,4)

InChIKey

BLJWXGLBHJPREZ-UHFFFAOYSA-N

Smiles

CNc1ccc(NCCC[N+](C)(C)C)c2C(=O)c3ccccc3C(=O)c12.CC(=O)[O-]