Chem
J-GLOBAL ID:200907024343606032   Nikkaji number:J773.053E

3-Fluoro-4-[4-(butylcarbamoyl)benzyloxy]benzoic acid pentafluorophenyl ester

3-フルオロ-4-[4-(ブチルカルバモイル)ベンジルオキシ]安息香酸ペンタフルオロフェニル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C25H19F6NO4
Molecular formula furigana: C25-H19-F6-N-O4
Molecular weight: 511.420
InChI: InChI=1S/C25H19F6NO4/c1-2-3-10-32-24(33)14-6-4-13(5-7-14)12-35-17-9-8-15(11-16(17)26)25(34)36-23-21(30)19(28)18(27)20(29)22(23)31/h4-9,11H,2-3,10,12H2,1H3,(H,32,33)
InChI key: SSTWTPPMMILLNQ-UHFFFAOYSA-N
SMILES: CCCCNC(=O)c1ccc(COc2ccc(cc2F)C(=O)Oc2c(F)c(F)c(F)c(F)c2F)cc1
Systematic name  (3):
  • 3-フルオロ-4-[4-(ブチルカルバモイル)ベンジルオキシ]安息香酸ペンタフルオロフェニル
  • 2,3,4,5,6-ペンタフルオロフェニル 4-{[4-(ブチルカルバモイル)フェニル]メトキシ}-3-フルオロベンゾアート
  • 2,3,4,5,6-pentafluorophenyl 4-{[4-(butylcarbamoyl)phenyl]methoxy}-3-fluorobenzoate
Other name (1):
  • 3-Fluoro-4-[4-(butylcarbamoyl)benzyloxy]benzoic acid pentafluorophenyl ester
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