Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, ester with (cis-1,2,trans-1,3,trans-1,4)-2,4-diphenyl-1,3-cyclobutanedicarboxylic acid (2:1)
RN: 10066-72-5
InChIKey: VSFHPDMZQSQFES-QZOBRWBISA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H48-N2-O4.2I

Molecular Weight

  • 778.541
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, ester with (cis-1,2,trans-1,3,trans-1,4)-2,4-diphenyl-1,3-cyclobutanedicarboxylic acid (2:1)

Registry Numbers

CAS Registry Number

  • 10066-72-5

System Generated Number

  • 0010066725

Molecular Formulas

Molecular Formula

  • C32-H48-N2-O4.2I

Molecular Formula Fragments

  • C32-H48-N2-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C32H48N2O4.2HI/c1-7-33(5,8-2)21-23-37-31(35)29-27(25-17-13-11-14-18-25)30(28(29)26-19-15-12-16-20-26)32(36)38-24-22-34(6,9-3)10-4;;/h11-20,27-30H,7-10,21-24H2,1-6H3;2*1H/q+2;;/p-2/t27-,28-,29-,30-;;

InChIKey

VSFHPDMZQSQFES-QZOBRWBISA-L

Smiles

c1([C@H]2[C@@H]([C@@H](c3ccccc3)[C@H]2C(OCC[N+](CC)(CC)C)=O)C(OCC[N+](CC)(CC)C)=O)ccccc1.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2300ug/kg (2.3mg/kg)   Farmakologiya i Toksikologiya Vol. 29, Pg. 53, 1966.