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Substance Name: Ammonium, (2-(4-imidazolylmethoxy)ethyl)trimethyl-, dipicrate
ID: BR64400000
InChIKey: CLNVHXMMONCMHF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H18-N3-O.2C6-H3-N3-O7

Molecular Weight

  • 642.4686
 
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Names and Synonyms

Synonyms

  • (2-(4-Imidazolylmethoxy)ethyl)trimethylammonium dipicrate
  • Imidazolemethoxycholine dipicrate

Systematic Name

  • Ammonium, (2-(4-imidazolylmethoxy)ethyl)trimethyl-, dipicrate

Registry Numbers

ID Number

  • NIOSH/BR6440000

System Generated Number

  • BR64400000

Molecular Formulas

Molecular Formula

  • C9-H18-N3-O.2C6-H3-N3-O7

Molecular Formula Fragments

  • C6-H3-N3-O7
  • C9-H18-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C9H18N3O.2C6H3N3O7/c1-12(2,3)4-5-13-7-9-6-10-8-11-9;2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h6,8H,4-5,7H2,1-3H3,(H,10,11);2*1-2,10H/q+1;;

InChIKey

CLNVHXMMONCMHF-UHFFFAOYSA-N

Smiles

C[N+](C)(C)CCOCc1c[nH]cn1.Oc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].Oc3c(cc(cc3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]