5-Bromo-4H-isoquinoline-1,3-dione
  -molcms-05142618572D

 13 14  0  0  0  0  0  0  0  0999 V2000
   -1.5000   -0.8660    0.0000 Br  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 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000    0.8660    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
    2.0000    0.0000    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
    0.5000   -0.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    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
    2.0000    1.7321    0.0000 O   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  2  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  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  6  2  0  0  0  0
 11  2  1  0  0  0  0
  9 12  2  0  0  0  0
  7 13  2  0  0  0  0
M  END
>  <ProductName>
5-Bromo-4H-isoquinoline-1,3-dione

>  <CASNumber>
1883494-21-0

>  <MolecularFormula>
C9H6BrNO2

>  <MDLNo>


>  <MolWt>
240.05

>  <BoilingPoint>


>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
BrC1=CC=CC2C(NC(CC=21)=O)=O

$$$$