Chem
J-GLOBAL ID:200907007404918596   Nikkaji number:J1.361.168H

5β-Benzyl-3,6-dioxopiperazine-2β-acetic acid butyl ester

5β-ベンジル-3,6-ジオキソピペラジン-2β-酢酸ブチル
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: C17H22N2O4
Molecular formula furigana: C17-H22-N2-O4
Molecular weight: 318.373
InChI: InChI=1S/C17H22N2O4/c1-2-3-9-23-15(20)11-14-17(22)18-13(16(21)19-14)10-12-7-5-4-6-8-12/h4-8,13-14H,2-3,9-11H2,1H3,(H,18,22)(H,19,21)/t13-,14-/m0/s1
InChI key: AOBKHFILGXUPSM-KBPBESRZSA-N
SMILES: CCCCOC(=O)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC1=O
Systematic name  (3):
  • 5β-ベンジル-3,6-ジオキソピペラジン-2β-酢酸ブチル
  • ブチル 2-[(2S,5S)-5-ベンジル-3,6-ジオキソピペラジン-2-イル]アセタート
  • butyl 2-[(2S,5S)-5-benzyl-3,6-dioxopiperazin-2-yl]acetate
Other name (1):
  • 5β-Benzyl-3,6-dioxopiperazine-2β-acetic acid butyl ester
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