Chem
J-GLOBAL ID：200907014009284460   Nikkaji number：J2.589.897D

2-Hydroxy-2-(trifluoromethyl)-3-(2-thienylcarbonyl)-4-[4-(dimethylamino)phenyl]-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-5-one

2-ヒドロキシ-2-(トリフルオロメチル)-3-(2-チエニルカルボニル)-4-[4-(ジメチルアミノ)フェニル]-3,4,5,6,7,8-ヘキサヒドロ-2H-1-ベンゾピラン-5-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： C23H22F3NO4S
Molecular formula furigana： C23-H22-F3-N-O4-S
Molecular weight： 465.490
InChI： InChI=1S/C23H22F3NO4S/c1-27(2)14-10-8-13(9-11-14)18-19-15(28)5-3-6-16(19)31-22(30,23(24,25)26)20(18)21(29)17-7-4-12-32-17/h4,7-12,18,20,30H,3,5-6H2,1-2H3
InChI key： BGSHDBNRLNDQRM-UHFFFAOYSA-N
SMILES： CN(C)c1ccc(cc1)C1C(C(=O)c2cccs2)C(O)(OC2=C1C(=O)CCC2)C(F)(F)F
Systematic name  (3)：
  • 2-ヒドロキシ-2-(トリフルオロメチル)-3-(2-チエニルカルボニル)-4-[4-(ジメチルアミノ)フェニル]-3,4,5,6,7,8-ヘキサヒドロ-2H-1-ベンゾピラン-5-オン
  • 4-[4-(ジメチルアミノ)フェニル]-2-ヒドロキシ-3-(チオフェン-2-カルボニル)-2-(トリフルオロメチル)-3,4,5,6,7,8-ヘキサヒドロ-2H-1-ベンゾピラン-5-オン
  • 4-[4-(dimethylamino)phenyl]-2-hydroxy-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-5-one
Other name (1)：
  • 2-Hydroxy-2-(trifluoromethyl)-3-(2-thienylcarbonyl)-4-[4-(dimethylamino)phenyl]-3,4,5,6,7,8-hexahydro-2H-1-benzopyran-5-one
Thsaurus map：
Thesaurus Map

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