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Substance Name: Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, alpha-phenylcyclohexaneglycolate, (+-)-
ID: BP76514000
InChIKey: VEBLNCKGXHQPRK-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H34-N-O3.I

Molecular Weight

  • 475.4036
 
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Names and Synonyms

Synonym

  • (+-)-Diethyl(2-hydroxyethyl)methylammonium iodide alpha-phenylcyclohexaneglycolate

Systematic Name

  • Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, alpha-phenylcyclohexaneglycolate, (+-)-

Registry Numbers

ID Number

  • NIOSH/BP7651400

System Generated Number

  • BP76514000

Molecular Formulas

Molecular Formula

  • C21-H34-N-O3.I

Molecular Formula Fragments

  • C21-H34-N-O3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C21H34NO3.HI/c1-4-22(3,5-2)16-17-25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6,8-9,12-13,19,24H,4-5,7,10-11,14-17H2,1-3H3;1H/q+1;/p-1

InChIKey

VEBLNCKGXHQPRK-UHFFFAOYSA-M

Smiles

[I-].CC[N+](C)(CC)CCOC(=O)C(O)(C1CCCCC1)c2ccccc2