Chem
J-GLOBAL ID:200907049366531849   Nikkaji number:J1.167.157H

(S)-2-Cyano-2-[(S)-1-phenylethyl]-4-pentenoic acid ethyl ester

(S)-2-シアノ-2-[(S)-1-フェニルエチル]-4-ペンテン酸エチル
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: C16H19NO2
Molecular formula furigana: C16-H19-N-O2
Molecular weight: 257.333
InChI: InChI=1S/C16H19NO2/c1-4-11-16(12-17,15(18)19-5-2)13(3)14-9-7-6-8-10-14/h4,6-10,13H,1,5,11H2,2-3H3/t13-,16+/m0/s1
InChI key: ZTZSOPNKTWWJCA-XJKSGUPXSA-N
SMILES: CCOC(=O)[C@](CC=C)(C#N)[C@@H](C)c1ccccc1
Systematic name  (3):
  • (S)-2-シアノ-2-[(S)-1-フェニルエチル]-4-ペンテン酸エチル
  • エチル (2S)-2-シアノ-2-[(1S)-1-フェニルエチル]ペンタ-4-エノアート
  • ethyl (2S)-2-cyano-2-[(1S)-1-phenylethyl]pent-4-enoate
Other name (1):
  • (S)-2-Cyano-2-[(S)-1-phenylethyl]-4-pentenoic acid ethyl ester
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