Chem
J-GLOBAL ID:201607014429914422   Nikkaji number:J3.474.853E

Trifluoromethanesulfonic acid ((E)-1-(4-acetylaminophenyl)-2-methyl-3,3,3-trifluoro-1-propenyl) ester

トリフルオロメタンスルホン酸((E)-1-(4-アセチルアミノフェニル)-2-メチル-3,3,3-トリフルオロ-1-プロペニル)
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: C13H11F6NO4S
Molecular formula furigana: C13-H11-F6-N-O4-S
Molecular weight: 391.280
InChI: InChI=1S/C13H11F6NO4S/c1-7(12(14,15)16)11(24-25(22,23)13(17,18)19)9-3-5-10(6-4-9)20-8(2)21/h3-6H,1-2H3,(H,20,21)/b11-7+
InChI key: GWWRNMLSJJLUCC-YRNVUSSQSA-N
SMILES: CC(=O)Nc1ccc(cc1)/C(=C(/C)\C(F)(F)F)/OS(=O)(=O)C(F)(F)F
Systematic name  (3):
  • トリフルオロメタンスルホン酸((E)-1-(4-アセチルアミノフェニル)-2-メチル-3,3,3-トリフルオロ-1-プロペニル)
  • (1E)-1-(4-アセトアミドフェニル)-3,3,3-トリフルオロ-2-メチルプロパ-1-エン-1-イル トリフルオロメタンスルホナート
  • (1E)-1-(4-acetamidophenyl)-3,3,3-trifluoro-2-methylprop-1-en-1-yl trifluoromethanesulfonate
Other name (1):
  • Trifluoromethanesulfonic acid ((E)-1-(4-acetylaminophenyl)-2-methyl-3,3,3-trifluoro-1-propenyl) ester
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