5-Amino-2-benzoylisoxazol-3(2H)-one
  -molcms-06172610102D

 15 16  0  0  0  0  0  0  0  0999 V2000
    0.3090    0.9511    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3090    0.9511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6180    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8090   -0.5878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9511   -0.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6942    0.3601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6453    0.0511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3884    0.7202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1805    1.6984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2294    2.0074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4863    1.3383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1590   -1.2872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8090   -1.5878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8968    1.7601    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
  6 13  2  0  0  0  0
  4 14  2  0  0  0  0
  2 15  1  0  0  0  0
M  END
>  <ProductName>
5-Amino-2-benzoylisoxazol-3(2H)-one

>  <CASNumber>
90771-25-8

>  <MolecularFormula>
C10H8N2O3

>  <MDLNo>


>  <MolWt>
204.18

>  <BoilingPoint>


>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
O1C(=CC(N1C(C1C=CC=CC=1)=O)=O)N

$$$$