Chem
J-GLOBAL ID：200907035686864055   Nikkaji number：J2.021.991B

4-Oxo-4-(benzylamino)crotonic acid

4-オキソ-4-(ベンジルアミノ)クロトン酸
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： C11H11NO3
Molecular formula furigana： C11-H11-N-O3
Molecular weight： 205.213
InChI： InChI=1S/C11H11NO3/c13-10(6-7-11(14)15)12-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13)(H,14,15)/b7-6+
InChI key： BHWGQIYJCMMSNM-VOTSOKGWSA-N
SMILES： OC(=O)/C=C/C(=O)NCc1ccccc1
Systematic name  (4)：
  • (E)-4-オキソ-4-(ベンジルアミノ)-2-ブテン酸
  • 4-オキソ-4-(ベンジルアミノ)クロトン酸
  • (2E)-3-(ベンジルカルバモイル)プロパ-2-エン酸
  • (2E)-3-(benzylcarbamoyl)prop-2-enoic acid
Other name (2)：
  • (E)-4-Oxo-4-(benzylamino)-2-butenoic acid
  • 4-Oxo-4-(benzylamino)crotonic acid
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