-ISIS-  08251613502D

 19 20  0  0  0  0  0  0  0  0999 V2000
    3.0833    0.0417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2250   -0.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4375   -1.4167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1292    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7958   -0.6292    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.9958    1.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1292    0.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4208   -1.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9708   -0.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8708    1.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2667    1.5292    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.8708    0.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7208    1.5292    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2458   -0.4958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3542    0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2250    0.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7167   -1.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3792    0.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4833   -0.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  7  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  2  0  0  0  0
  7 14  1  0  0  0  0
  8  5  1  0  0  0  0
  9  7  2  0  0  0  0
 10 12  2  0  0  0  0
 11  4  1  0  0  0  0
 12  9  1  0  0  0  0
 13 10  1  0  0  0  0
 14 18  1  0  0  0  0
 15  2  1  0  0  0  0
 16  5  1  0  0  0  0
 17  5  1  0  0  0  0
 18 19  1  0  0  0  0
 19 15  1  0  0  0  0
  8  3  1  0  0  0  0
 10  6  1  0  0  0  0
M  END
>  <ID> (STL308430)
STL308430

>  <Rotatable_Bonds> (STL308430)
5

>  <logP> (STL308430)
3.667

>  <PSA> (STL308430)
30.82

>  <H_Donors> (STL308430)
0

>  <H_Acceptors> (STL308430)
2

>  <Number_of_rings> (STL308430)
2

>  <NAME> (STL308430)
2-[3-(2,4-dichlorophenoxy)propyl]-4,4-dimethyl-4,5-dihydro-1,3-oxazole

>  <Mol_Weight> (STL308430)
302.20

>  <Mol_Formula> (STL308430)
C14H17Cl2NO2

>  <Smiles> (STL308430)
Clc1ccc(c(c1)Cl)OCCCC1=NC(CO1)(C)C

$$$$