Chem
J-GLOBAL ID:200907009265325910   Nikkaji number:J2.583.406B

(S)-α-Fluoro-α-cyano-N-[(R)-1,2,2-trimethylpropyl]-4-methylbenzeneacetamide

(S)-α-フルオロ-α-シアノ-N-[(R)-1,2,2-トリメチルプロピル]-4-メチルベンゼンアセトアミド
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: C16H21FN2O
Molecular formula furigana: C16-H21-F-N2-O
Molecular weight: 276.355
InChI: InChI=1S/C16H21FN2O/c1-11-6-8-13(9-7-11)16(17,10-18)14(20)19-12(2)15(3,4)5/h6-9,12H,1-5H3,(H,19,20)/t12-,16-/m1/s1
InChI key: ZLPQEUDQNHKUHS-MLGOLLRUSA-N
SMILES: C[C@@H](NC(=O)[C@@](F)(C#N)c1ccc(C)cc1)C(C)(C)C
Systematic name  (3):
  • (S)-α-フルオロ-α-シアノ-N-[(R)-1,2,2-トリメチルプロピル]-4-メチルベンゼンアセトアミド
  • (2S)-2-シアノ-N-[(2R)-3,3-ジメチルブタン-2-イル]-2-フルオロ-2-(4-メチルフェニル)アセトアミド
  • (2S)-2-cyano-N-[(2R)-3,3-dimethylbutan-2-yl]-2-fluoro-2-(4-methylphenyl)acetamide
Other name (1):
  • (S)-α-Fluoro-α-cyano-N-[(R)-1,2,2-trimethylpropyl]-4-methylbenzeneacetamide
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