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Substance Name: Piperazinium, 1-(9,10-dihydro-9,10-ethanoanthracen-11-ylmethyl)-1,4-dimethyl-4-(2-hydroxyethyl)-, diiodide
RN: 10058-62-5
InChIKey: GWATVPUJMYSHAD-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H34-N2-O.2I

Molecular Weight

  • 632.357
 
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Names and Synonyms

Synonym

  • 9,10-Dihydro-11-(4-(2-hydroxyethyl)-1-piperazinylmethyl)-9,10-ethanoanthracene dimethyliodide

Systematic Name

  • Piperazinium, 1-(9,10-dihydro-9,10-ethanoanthracen-11-ylmethyl)-1,4-dimethyl-4-(2-hydroxyethyl)-, diiodide

Registry Numbers

CAS Registry Number

  • 10058-62-5

System Generated Number

  • 0010058625

Molecular Formulas

Molecular Formula

  • C25-H34-N2-O.2I

Molecular Formula Fragments

  • C25-H34-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C25H34N2O.2HI/c1-26(15-16-28)11-13-27(2,14-12-26)18-19-17-24-20-7-3-5-9-22(20)25(19)23-10-6-4-8-21(23)24;;/h3-10,19,24-25,28H,11-18H2,1-2H3;2*1H/q+2;;/p-2

InChIKey

GWATVPUJMYSHAD-UHFFFAOYSA-L

Smiles

[N+]1(CCO)(C)CC[N+](C[C@@H]2C3c4c(C(c5c3cccc5)C2)cccc4)(C)CC1.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 25mg/kg (25mg/kg)   Journal of Medicinal Chemistry. Vol. 10, Pg. 86, 1967.