Chem
J-GLOBAL ID:200907009023540468
Nikkaji number:J2.583.404F
(S)-α-Fluoro-α-cyano-N-[(S)-sec-butyl]-4-methylbenzeneacetamide
(S)-α-フルオロ-α-シアノ-N-[(S)-sec-ブチル]-4-メチルベンゼンアセトアミド
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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 H17 FN2 O
Molecular formula furigana:
C14-H17-F-N2-O
Molecular weight:
248.301
InChI:
InChI=1S/C14H17FN2O/c1-4-11(3)17-13(18)14(15,9-16)12-7-5-10(2)6-8-12/h5-8,11H,4H2,1-3H3,(H,17,18)/t11-,14+/m0/s1
InChI key:
OTTZBHHPOJEKKL-SMDDNHRTSA-N
SMILES:
CC[C@H](C)NC(=O)[C@@](F)(C#N)c1ccc(C)cc1
Systematic name (3):
(S)-α-フルオロ-α-シアノ-N-[(S)-sec-ブチル]-4-メチルベンゼンアセトアミド
(2S)-N-[(2S)-ブタン-2-イル]-2-シアノ-2-フルオロ-2-(4-メチルフェニル)アセトアミド
(2S)-N-[(2S)-butan-2-yl]-2-cyano-2-fluoro-2-(4-methylphenyl)acetamide
Other name (1):
(S)-α-Fluoro-α-cyano-N-[(S)-sec-butyl]-4-methylbenzeneacetamide
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