-ISIS-  08251615082D

 21 22  0  0  0  0  0  0  0  0999 V2000
    2.1667   -0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0292    0.2583    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1667   -1.2417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8917   -0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8958    1.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1708    0.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0333    1.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1583    1.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8875    0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0250   -0.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7625    1.7417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2958   -0.2417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2958    0.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4417    0.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8917   -1.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7583    0.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6250    1.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4333   -0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7417   -1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6208   -0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6208   -1.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  9  1  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  8  6  2  0  0  0  0
  9 10  2  0  0  0  0
 10  6  1  0  0  0  0
 11  5  1  0  0  0  0
 12 14  1  0  0  0  0
 13  1  1  0  0  0  0
 14 18  1  0  0  0  0
 15  4  2  0  0  0  0
 16  4  1  0  0  0  0
 17 11  1  0  0  0  0
 18 13  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  2  0  0  0  0
 21 20  1  0  0  0  0
 21 19  2  0  0  0  0
  5  7  2  0  0  0  0
M  END
>  <ID> (STL455241)
STL455241

>  <Rotatable_Bonds> (STL455241)
4

>  <logP> (STL455241)
3.296

>  <PSA> (STL455241)
47.56

>  <H_Donors> (STL455241)
1

>  <H_Acceptors> (STL455241)
3

>  <Number_of_rings> (STL455241)
2

>  <NAME> (STL455241)
4-(4-methoxyphenoxy)-N-phenylbutanamide

>  <Mol_Weight> (STL455241)
285.34

>  <Mol_Formula> (STL455241)
C17H19NO3

>  <Smiles> (STL455241)
COc1ccc(cc1)OCCCC(=O)Nc1ccccc1

$$$$