Chem
J-GLOBAL ID:200907092692836563
Nikkaji number:J2.583.413E
(S)-α-Fluoro-α-cyano-N-[(S)-α,4-dimethylbenzyl]-4-methylbenzeneacetamide
(S)-α-フルオロ-α-シアノ-N-[(S)-α,4-ジメチルベンジル]-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:
C19 H19 FN2 O
Molecular formula furigana:
C19-H19-F-N2-O
Molecular weight:
310.372
InChI:
InChI=1S/C19H19FN2O/c1-13-4-8-16(9-5-13)15(3)22-18(23)19(20,12-21)17-10-6-14(2)7-11-17/h4-11,15H,1-3H3,(H,22,23)/t15-,19+/m0/s1
InChI key:
NIWQGKFYRYAGBN-HNAYVOBHSA-N
SMILES:
C[C@H](NC(=O)[C@@](F)(C#N)c1ccc(C)cc1)c1ccc(C)cc1
Systematic name (3):
(S)-α-フルオロ-α-シアノ-N-[(S)-α,4-ジメチルベンジル]-4-メチルベンゼンアセトアミド
(2S)-2-シアノ-2-フルオロ-2-(4-メチルフェニル)-N-[(1S)-1-(4-メチルフェニル)エチル]アセトアミド
(2S)-2-cyano-2-fluoro-2-(4-methylphenyl)-N-[(1S)-1-(4-methylphenyl)ethyl]acetamide
Other name (1):
(S)-α-Fluoro-α-cyano-N-[(S)-α,4-dimethylbenzyl]-4-methylbenzeneacetamide
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