Chem
J-GLOBAL ID：200907069446518275   Nikkaji number：J1.459.211C

(2S)-N-[4-(Trifluoromethyl)phenyl]-1-(tert-butoxycarbonyl)indoline-2α-carboxamide

(2S)-N-[4-(トリフルオロメチル)フェニル]-1-(tert-ブトキシカルボニル)インドリン-2α-カルボアミド
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： C21H21F3N2O3
Molecular formula furigana： C21-H21-F3-N2-O3
Molecular weight： 406.405
InChI： InChI=1S/C21H21F3N2O3/c1-20(2,3)29-19(28)26-16-7-5-4-6-13(16)12-17(26)18(27)25-15-10-8-14(9-11-15)21(22,23)24/h4-11,17H,12H2,1-3H3,(H,25,27)/t17-/m0/s1
InChI key： JPMKEJBZZZXURM-KRWDZBQOSA-N
SMILES： CC(C)(C)OC(=O)N1[C@@H](Cc2ccccc12)C(=O)Nc1ccc(cc1)C(F)(F)F
Systematic name  (3)：
  • (2S)-N-[4-(トリフルオロメチル)フェニル]-1-(tert-ブトキシカルボニル)インドリン-2α-カルボアミド
  • tert-ブチル (2S)-2-{[4-(トリフルオロメチル)フェニル]カルバモイル}-2,3-ジヒドロ-1H-インドール-1-カルボキシラート
  • tert-butyl (2S)-2-{[4-(trifluoromethyl)phenyl]carbamoyl}-2,3-dihydro-1H-indole-1-carboxylate
Other name (1)：
  • (2S)-N-[4-(Trifluoromethyl)phenyl]-1-(tert-butoxycarbonyl)indoline-2α-carboxamide
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