-ISIS-  08251613322D

 19 20  0  0  0  0  0  0  0  0999 V2000
    0.7333    0.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7708   -0.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2333   -0.8125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2917    0.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2917   -1.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7375   -0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3042    0.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3042   -1.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4833    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8208   -0.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2833    0.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8000   -2.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0125    0.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8333   -0.8125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2875    0.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8333    1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3667    2.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8292    1.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3792    2.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  2  0  0  0  0
  6  1  1  0  0  0  0
  7  4  2  0  0  0  0
  8  5  1  0  0  0  0
  9  1  2  0  0  0  0
 10  8  2  0  0  0  0
 11  6  1  0  0  0  0
 12  5  1  0  0  0  0
 13  4  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  2  0  0  0  0
 16 11  1  0  0  0  0
 17 16  2  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 19 18  2  0  0  0  0
 10  7  1  0  0  0  0
M  END
>  <ID> (STK672739)
STK672739

>  <Rotatable_Bonds> (STK672739)
1

>  <logP> (STK672739)
4.68

>  <PSA> (STK672739)
38.33

>  <H_Donors> (STK672739)
1

>  <H_Acceptors> (STK672739)
2

>  <Number_of_rings> (STK672739)
2

>  <NAME> (STK672739)
phenyl (2,4,6-trimethylphenyl)carbamate

>  <Mol_Weight> (STK672739)
255.32

>  <Mol_Formula> (STK672739)
C16H17NO2

>  <Smiles> (STK672739)
O=C(Nc1c(C)cc(cc1C)C)Oc1ccccc1

$$$$