Chem
J-GLOBAL ID:200907017336735408   Nikkaji number:J1.633.867B

[2,3-Difluoro-3-(4-chloro-α-fluorobenzyl)-2,3-dihydro-4H-1-benzothiopyran-4-one]1,1-dioxide

[2,3-ジフルオロ-3-(4-クロロ-α-フルオロベンジル)-2,3-ジヒドロ-4H-1-ベンゾチオピラン-4-オン]1,1-ジオキシド
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: C16H10ClF3O[O-]2[S+2]
Molecular formula furigana: C16-H10-CL-F3-O3-S
Molecular weight: 374.760
InChI: InChI=1S/C16H10ClF3O3S/c17-10-7-5-9(6-8-10)13(18)16(20)14(21)11-3-1-2-4-12(11)24(22,23)15(16)19/h1-8,13,15H
InChI key: BPOHTHRCMCZXSG-UHFFFAOYSA-N
SMILES: [O-][S+2]1([O-])C(F)C(F)(C(F)c2ccc(Cl)cc2)C(=O)c2ccccc12
Systematic name  (3):
  • [2,3-ジフルオロ-3-(4-クロロ-α-フルオロベンジル)-2,3-ジヒドロ-4H-1-ベンゾチオピラン-4-オン]1,1-ジオキシド
  • 3-[(4-クロロフェニル)(フルオロ)メチル]-2,3-ジフルオロ-4-オキソ-1,2,3,4-テトラヒドロ-1-ベンゾチオピラン-1,1-ジイウム-1,1-ビス(オラート)
  • 3-[(4-chlorophenyl)(fluoro)methyl]-2,3-difluoro-4-oxo-1,2,3,4-tetrahydro-1-benzothiopyran-1,1-diium-1,1-bis(olate)
Other name (1):
  • [2,3-Difluoro-3-(4-chloro-α-fluorobenzyl)-2,3-dihydro-4H-1-benzothiopyran-4-one]1,1-dioxide
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