Chem
J-GLOBAL ID：200907024155749934   Nikkaji number：J2.314.871D

2-[(S)-1-(tert-Butoxycarbonylamino)propyl]malonic acid dibenzyl ester

2-[(S)-1-(tert-ブトキシカルボニルアミノ)プロピル]マロン酸ジベンジル
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： C25H31NO6
Molecular formula furigana： C25-H31-N-O6
Molecular weight： 441.524
InChI： InChI=1S/C25H31NO6/c1-5-20(26-24(29)32-25(2,3)4)21(22(27)30-16-18-12-8-6-9-13-18)23(28)31-17-19-14-10-7-11-15-19/h6-15,20-21H,5,16-17H2,1-4H3,(H,26,29)/t20-/m0/s1
InChI key： ARFALORUYNJYCY-FQEVSTJZSA-N
SMILES： CC[C@H](NC(=O)OC(C)(C)C)C(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-[(S)-1-(tert-ブトキシカルボニルアミノ)プロピル]マロン酸ジベンジル
  • 1,3-ジベンジル 2-[(1S)-1-{[(tert-ブトキシ)カルボニル]アミノ}プロピル]プロパンジオアート
  • 1,3-dibenzyl 2-[(1S)-1-{[(tert-butoxy)carbonyl]amino}propyl]propanedioate
Other name (1)：
  • 2-[(S)-1-(tert-Butoxycarbonylamino)propyl]malonic acid dibenzyl ester
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