-ISIS-  08251614582D

 21 20  0  0  0  0  0  0  0  0999 V2000
   -4.3375    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4750   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3375    1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4750   -1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2000   -0.2458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6000    0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9250   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7917    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0625    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7375   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8667    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9208   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0542    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7208   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5958    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4583   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3292    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1917   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0042   -0.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8583    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7917    0.2500    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  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  9  1  0  0  0  0
  8  7  2  0  0  0  0
  9  5  1  0  0  0  0
 10  6  1  0  0  0  0
 11 10  1  0  0  0  0
 12 13  1  0  0  0  0
 13 18  1  0  0  0  0
 14 20  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 11  1  0  0  0  0
 20 19  1  0  0  0  0
 21 12  1  0  0  0  0
M  END
>  <ID> (STK048041)
STK048041

>  <Rotatable_Bonds> (STK048041)
14

>  <logP> (STK048041)
5.38

>  <PSA> (STK048041)
58.2

>  <H_Donors> (STK048041)
2

>  <H_Acceptors> (STK048041)
2

>  <Number_of_rings> (STK048041)
0

>  <NAME> (STK048041)
N-dodecyl-N'-(prop-2-en-1-yl)ethanediamide

>  <Mol_Weight> (STK048041)
296.45

>  <Mol_Formula> (STK048041)
C17H32N2O2

>  <Smiles> (STK048041)
CCCCCCCCCCCCNC(=O)C(=O)NCC=C

$$$$