Chem
J-GLOBAL ID:200907069334501957   Nikkaji number:J2.583.414C

N-[(S)-Fluorocyano(4-methylphenyl)acetyl]-L-alanine methyl ester

N-[(S)-フルオロシアノ(4-メチルフェニル)アセチル]-L-アラニンメチル
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: C14H15FN2O3
Molecular formula furigana: C14-H15-F-N2-O3
Molecular weight: 278.283
InChI: InChI=1S/C14H15FN2O3/c1-9-4-6-11(7-5-9)14(15,8-16)13(19)17-10(2)12(18)20-3/h4-7,10H,1-3H3,(H,17,19)/t10-,14+/m0/s1
InChI key: WKIHVEUOAWJCJV-IINYFYTJSA-N
SMILES: COC(=O)[C@H](C)NC(=O)[C@@](F)(C#N)c1ccc(C)cc1
Systematic name  (3):
  • N-[(S)-フルオロシアノ(4-メチルフェニル)アセチル]-L-アラニンメチル
  • メチル (2S)-2-[(2S)-2-シアノ-2-フルオロ-2-(4-メチルフェニル)アセトアミド]プロパノアート
  • methyl (2S)-2-[(2S)-2-cyano-2-fluoro-2-(4-methylphenyl)acetamido]propanoate
Other name (1):
  • N-[(S)-Fluorocyano(4-methylphenyl)acetyl]-L-alanine methyl ester
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