-ISIS-  08251614332D

 27 31  0  0  0  0  0  0  0  0999 V2000
    1.4208    0.8750    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    0.8333    0.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8333    1.6792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1042    0.3792    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1042    1.3750    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9708   -0.1167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.8292    0.3792    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9708    1.8708    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.4125    0.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6875   -0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4750    0.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8292    1.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9083    1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3292    2.5458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3292   -0.7792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5458    0.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6875   -1.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4042   -0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9000    1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5458   -1.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4042   -1.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9083    0.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4000    2.5958    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.9000    0.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5458    1.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4000    0.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5458   -2.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10  7  1  0  0  0  0
 11  8  1  0  0  0  0
 12  8  1  0  0  0  0
 13  9  2  0  0  0  0
 14  3  2  0  0  0  0
 15  2  2  0  0  0  0
 16 10  1  0  0  0  0
 17 10  2  0  0  0  0
 18 16  2  0  0  0  0
 19 13  1  0  0  0  0
 20 17  1  0  0  0  0
 21 20  2  0  0  0  0
 22  9  1  0  0  0  0
 23 19  1  0  0  0  0
 24 22  2  0  0  0  0
 25 16  1  0  0  0  0
 26 24  1  0  0  0  0
 27 20  1  0  0  0  0
  4  5  1  0  0  0  0
 26 19  2  0  0  0  0
  7 12  1  0  0  0  0
  6 11  1  0  0  0  0
 18 21  1  0  0  0  0
M  END
>  <ID> (STK265897)
STK265897

>  <Rotatable_Bonds> (STK265897)
1

>  <logP> (STK265897)
4.794

>  <PSA> (STK265897)
37.38

>  <H_Donors> (STK265897)
0

>  <H_Acceptors> (STK265897)
2

>  <Number_of_rings> (STK265897)
5

>  <NAME> (STK265897)
2-(3-chlorophenyl)-5-(2,5-dimethylphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

>  <Mol_Weight> (STK265897)
379.89

>  <Mol_Formula> (STK265897)
C23H22ClNO2

>  <Smiles> (STK265897)
Cc1ccc(c(c1)C1CC2CC1C1C2C(=O)N(C1=O)c1cccc(c1)Cl)C

$$$$