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Substance Name: Oxypyrronium cation
RN: 116533-64-3
UNII: 1IH4C995X0
InChIKey: KASKRXOORXMTTP-UHFFFAOYSA-N

Molecular Formula

  • C21-H32-N-O3

Molecular Weight

  • 346.4878
 
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Names and Synonyms

Name of Substance

  • Oxypyrronium cation

Synonyms

  • Oxypyrronium
  • UNII-1IH4C995X0

Systematic Name

  • 2-(2-Hydroxymethyl)-1,1-dimethyl)pyrrolidinium alpha-phenylcyclohexaneglycolate

Registry Numbers

CAS Registry Number

  • 116533-64-3

FDA UNII

  • 1IH4C995X0

System Generated Number

  • 0116533643

Structure Descriptors

InChI

1S/C21H32NO3/c1-22(2)15-9-14-19(22)16-25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3,5-6,10-11,18-19,24H,4,7-9,12-16H2,1-2H3/q+1

InChIKey

KASKRXOORXMTTP-UHFFFAOYSA-N

Smiles

C[N+]1(C)CCCC1COC(=O)C(O)(C2CCCCC2)c3ccccc3