Chem
J-GLOBAL ID：200907002671887584   Nikkaji number：J1.361.162I

3-(5β-Isopropyl-3,6-dioxopiperazine-2β-yl)propanoic acid 2-ethylhexyl ester

3-(5β-イソプロピル-3,6-ジオキソピペラジン-2β-イル)プロパン酸2-エチルヘキシル
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： C18H32N2O4
Molecular formula furigana： C18-H32-N2-O4
Molecular weight： 340.464
InChI： InChI=1S/C18H32N2O4/c1-5-7-8-13(6-2)11-24-15(21)10-9-14-17(22)20-16(12(3)4)18(23)19-14/h12-14,16H,5-11H2,1-4H3,(H,19,23)(H,20,22)/t13?,14-,16-/m0/s1
InChI key： CBPIMKZWVKSCAW-DSUHRAPHSA-N
SMILES： CCCCC(CC)COC(=O)CC[C@@H]1NC(=O)[C@@H](NC1=O)C(C)C
Systematic name  (3)：
  • 3-(5β-イソプロピル-3,6-ジオキソピペラジン-2β-イル)プロパン酸2-エチルヘキシル
  • 2-エチルヘキシル 3-[(2S,5S)-3,6-ジオキソ-5-(プロパン-2-イル)ピペラジン-2-イル]プロパノアート
  • 2-ethylhexyl 3-[(2S,5S)-3,6-dioxo-5-(propan-2-yl)piperazin-2-yl]propanoate
Other name (1)：
  • 3-(5β-Isopropyl-3,6-dioxopiperazine-2β-yl)propanoic acid 2-ethylhexyl ester
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