Chem
J-GLOBAL ID:200907002046905507   Nikkaji number:J2.775.431G

3-[(S)-α-(2-Oxopropyl)-3-(trifluoromethyl)benzyl]-4-hydroxy-2H-1-benzopyran-2-one

4-ヒドロキシ-3-[(1S)-3-オキソ-1-[3-(トリフルオロメチル)フェニル]ブチル]-2H-クロメン-2-オン
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: C20H15F3O4
Molecular formula furigana: C20-H15-F3-O4
Molecular weight: 376.331
InChI: InChI=1S/C20H15F3O4/c1-11(24)9-15(12-5-4-6-13(10-12)20(21,22)23)17-18(25)14-7-2-3-8-16(14)27-19(17)26/h2-8,10,15,25H,9H2,1H3/t15-/m0/s1
InChI key: BOZHGTGDVOZPTP-HNNXBMFYSA-N
SMILES: CC(=O)C[C@@H](c1cccc(c1)C(F)(F)F)c1c(O)c2ccccc2oc1=O
Systematic name  (3):
  • 3-[(S)-α-(2-オキソプロピル)-3-(トリフルオロメチル)ベンジル]-4-ヒドロキシ-2H-1-ベンゾピラン-2-オン
  • 4-ヒドロキシ-3-[(1S)-3-オキソ-1-[3-(トリフルオロメチル)フェニル]ブチル]-2H-クロメン-2-オン
  • 4-hydroxy-3-[(1S)-3-oxo-1-[3-(trifluoromethyl)phenyl]butyl]-2H-chromen-2-one
Other name (1):
  • 3-[(S)-α-(2-Oxopropyl)-3-(trifluoromethyl)benzyl]-4-hydroxy-2H-1-benzopyran-2-one
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