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Substance Name: Ibuprofen dimethyl aminoethanol octyl
RN: 113168-14-2
InChIKey: DTGYJWMLFMGLOM-UHFFFAOYSA-M

Molecular Formula

  • C25-H44-N-O2.Br

Molecular Weight

  • 470.532
 
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Names and Synonyms

Results Name

  • Ibuprofen dimethyl aminoethanol octyl

Name of Substance

  • Ibuprofen dimethyl aminoethanol octyl

Synonyms

  • AF-150
  • AF-150 (onium compound)
  • Ibuprofen dimethyl aminoethanol octyl
  • N,N-Dimethyl-N-(2-(2-(4-(2-methylpropyl)phenyl)-1-oxopropoxy)ethyl)-1-octanaminium bromide

Systematic Name

  • 1-Octanaminium, N,N-dimethyl-N-(2-(2-(4-(2-methylpropyl)phenyl)-1-oxopropoxy)ethyl)-, bromide

Registry Numbers

CAS Registry Number

  • 113168-14-2

System Generated Number

  • 0113168142

Molecular Formulas

Molecular Formula

  • C25-H44-N-O2.Br

Molecular Formula Fragments

  • Br
  • C25-H44-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C25H44NO2.BrH/c1-7-8-9-10-11-12-17-26(5,6)18-19-28-25(27)22(4)24-15-13-23(14-16-24)20-21(2)3;/h13-16,21-22H,7-12,17-20H2,1-6H3;1H/q+1;/p-1

InChIKey

DTGYJWMLFMGLOM-UHFFFAOYSA-M

Smiles

C(CCCCCCC)[N+](CCOC([C@@H](C)c1ccc(cc1)CC(C)C)=O)(C)C.[BrH-]