-ISIS-  08091621332D

 19 20  0  0  0  0  0  0  0  0999 V2000
   -0.8667    0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7292   -0.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0083   -0.2542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8542    0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7250   -0.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5917    0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6042    0.2417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8667    1.2417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8542    1.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5917    1.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6042    1.2417    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.4583    1.7542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7250    1.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7250   -1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7292   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4625   -0.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8542   -1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6042   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4625   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  2  1  0  0  0  0
  8  1  2  0  0  0  0
  9  4  1  0  0  0  0
 10 13  1  0  0  0  0
 11  7  1  0  0  0  0
 12 10  1  0  0  0  0
 13  9  2  0  0  0  0
 14  5  1  0  0  0  0
 15  2  2  0  0  0  0
 16  7  2  0  0  0  0
 17 14  1  0  0  0  0
 18 15  1  0  0  0  0
 19 18  2  0  0  0  0
 19 16  1  0  0  0  0
 10  6  2  0  0  0  0
M  END
>  <ID> (BBL000239)
BBL000239

>  <Rotatable_Bonds> (BBL000239)
2

>  <logP> (BBL000239)
0.991

>  <PSA> (BBL000239)
64.35

>  <H_Donors> (BBL000239)
3

>  <H_Acceptors> (BBL000239)
2

>  <Number_of_rings> (BBL000239)
2

>  <NAME> (BBL000239)
N-(4-amino-2-methoxyphenyl)-2-chlorobenzamide

>  <Mol_Weight> (BBL000239)
276.72

>  <Mol_Formula> (BBL000239)
C14H13ClN2O2

>  <Smiles> (BBL000239)
COc1cc(N)ccc1NC(=O)c1ccccc1Cl

>  <Alternative_identifier> (BBL000239)
MFCD02585686

$$$$