Chem
J-GLOBAL ID:200907050055211733   Nikkaji number:J1.551.794H

(3R)-3α-(3-Fluorobenzyloxy)-4α-(trifluoromethyl)-4-(cyclopropylethynyl)-6-chloro-1,2,3,4-tetrahydroquinoline-2-one

(3R)-3α-(3-フルオロベンジルオキシ)-4α-(トリフルオロメチル)-4-(シクロプロピルエチニル)-6-クロロ-1,2,3,4-テトラヒドロキノリン-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: C22H16ClF4NO2
Molecular formula furigana: C22-H16-CL-F4-N-O2
Molecular weight: 437.820
InChI: InChI=1S/C22H16ClF4NO2/c23-15-6-7-18-17(11-15)21(22(25,26)27,9-8-13-4-5-13)19(20(29)28-18)30-12-14-2-1-3-16(24)10-14/h1-3,6-7,10-11,13,19H,4-5,12H2,(H,28,29)/t19-,21+/m0/s1
InChI key: SHWDYIZCRSPGHW-PZJWPPBQSA-N
SMILES: Fc1cccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC2CC2)C(F)(F)F)c1
Systematic name  (3):
  • (3R)-3α-(3-フルオロベンジルオキシ)-4α-(トリフルオロメチル)-4-(シクロプロピルエチニル)-6-クロロ-1,2,3,4-テトラヒドロキノリン-2-オン
  • (3R,4R)-6-クロロ-4-(2-シクロプロピルエチニル)-3-[(3-フルオロフェニル)メトキシ]-4-(トリフルオロメチル)-1,2,3,4-テトラヒドロキノリン-2-オン
  • (3R,4R)-6-chloro-4-(2-cyclopropylethynyl)-3-[(3-fluorophenyl)methoxy]-4-(trifluoromethyl)-1,2,3,4-tetrahydroquinolin-2-one
Other name (1):
  • (3R)-3α-(3-Fluorobenzyloxy)-4α-(trifluoromethyl)-4-(cyclopropylethynyl)-6-chloro-1,2,3,4-tetrahydroquinoline-2-one
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