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Substance Name: Ammonium, diethyl(beta-hydroxyphenethyl)methyl-, iodide, 3,4-dichlorobenzoate (ester)
ID: BP76583000
InChIKey: PWIUPVCCSRSXOH-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl2-N-O2.I

Molecular Weight

  • 508.2206
 
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Names and Synonyms

Synonym

  • Diethyl(beta-hydroxyphenethyl)methylammonium iodide 3,4-dichlorobenzoate (ester)

Systematic Name

  • Ammonium, diethyl(beta-hydroxyphenethyl)methyl-, iodide, 3,4-dichlorobenzoate (ester)

Registry Numbers

ID Number

  • NIOSH/BP7658300

System Generated Number

  • BP76583000

Molecular Formulas

Molecular Formula

  • C20-H23-Cl2-N-O2.I

Molecular Formula Fragments

  • C20-H23-Cl2-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H24Cl2NO2.HI/c1-4-23(3,5-2)14-19(15-9-7-6-8-10-15)25-20(24)16-11-12-17(21)18(22)13-16;/h6-13,19H,4-5,14H2,1-3H3;1H/q+1;/p-1

InChIKey

PWIUPVCCSRSXOH-UHFFFAOYSA-M

Smiles

[I-].CC[N+](C)(CC)CC(OC(=O)c1ccc(Cl)c(Cl)c1)c2ccccc2