-ISIS-  08251613282D

 23 24  0  0  0  0  0  0  0  0999 V2000
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   -2.5708    4.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5708    2.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4417    2.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7083    3.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4417    3.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8750    2.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8750    4.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9000    1.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9000    2.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3042    2.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0375    0.5167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5708    5.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7667    0.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7667   -0.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3000   -4.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667   -3.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667   -2.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6042   -1.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6042   -2.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3000   -5.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  2  0  0  0  0
  7  1  2  0  0  0  0
  8  5  2  0  0  0  0
  9 11  1  0  0  0  0
 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 12  4  2  0  0  0  0
 13  9  2  0  0  0  0
 14 10  2  0  0  0  0
 15  2  1  0  0  0  0
 16  9  1  0  0  0  0
 17 16  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 22  1  0  0  0  0
 21 17  1  0  0  0  0
 22 21  1  0  0  0  0
 23 18  1  0  0  0  0
  8 14  1  0  0  0  0
  6  4  1  0  0  0  0
M  END
>  <ID> (STK624482)
STK624482

>  <Rotatable_Bonds> (STK624482)
9

>  <logP> (STK624482)
5.58

>  <PSA> (STK624482)
52.6

>  <H_Donors> (STK624482)
0

>  <H_Acceptors> (STK624482)
4

>  <Number_of_rings> (STK624482)
2

>  <NAME> (STK624482)
4-methyl-2-oxo-2H-chromen-7-yl nonanoate

>  <Mol_Weight> (STK624482)
316.40

>  <Mol_Formula> (STK624482)
C19H24O4

>  <Smiles> (STK624482)
CCCCCCCCC(=O)Oc1ccc2c(c1)oc(=O)cc2C

$$$$