Chem
J-GLOBAL ID:200907037747947636
Nikkaji number:J1.940.309B
2-[2-Chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzisothiazole-3-one
2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾチアゾール-3-オン
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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:
C14 H11 ClF3 NOS
Molecular formula furigana:
C14-H11-CL-F3-N-O-S
Molecular weight:
333.750
InChI:
InChI=1S/C14H11ClF3NOS/c15-10-7-8(14(16,17)18)5-6-11(10)19-13(20)9-3-1-2-4-12(9)21-19/h5-7H,1-4H2
InChI key:
DHHXUPAECPUDGT-UHFFFAOYSA-N
SMILES:
FC(F)(F)c1ccc(c(Cl)c1)n1sc2CCCCc2c1=O
Systematic name (3):
2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾイソチアゾール-3-オン
2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾチアゾール-3-オン
2-[2-chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzothiazol-3-one
Other name (1):
2-[2-Chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzisothiazole-3-one
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