1-benzyl 6-ethyl (S)-2-((tert-butoxycarbonyl)amino)-4-oxohexanedioate
  -molcms-06132612342D

 28 28  0  0  1  0  0  0  0  0999 V2000
   -0.5000   -0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000   -3.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -4.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000   -5.1962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -5.1962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000   -4.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5000    0.8660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0000    1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000    1.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5000    0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0000    1.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    1.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0000    1.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    2.5981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  4  1  0  0  0  0
  1 10  2  0  0  0  0
 11  1  1  1  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 13 19  2  0  0  0  0
 11 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 24 28  2  0  0  0  0
M  END
>  <ProductName>
1-benzyl 6-ethyl (S)-2-((tert-butoxycarbonyl)amino)-4-oxohexanedioate

>  <CASNumber>
250291-82-8

>  <MolecularFormula>
C20H27NO7

>  <MDLNo>


>  <MolWt>
393.43

>  <BoilingPoint>


>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
C(OCC1=CC=CC=C1)(=O)[C@@H](NC(OC(C)(C)C)=O)CC(=O)CC(OCC)=O

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