-ISIS-  08091621332D

 13 14  0  0  0  0  0  0  0  0999 V2000
    0.4167    0.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4167   -0.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4417    1.2458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3000   -0.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4167   -1.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3542    1.7417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3000   -1.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4167   -1.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1500    0.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3042    0.2542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3042   -1.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1542   -0.2167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1542   -1.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  4  2  0  0  0  0
  8  7  1  0  0  0  0
  9  4  1  0  0  0  0
 10  2  1  0  0  0  0
 11  5  1  0  0  0  0
 12 10  2  0  0  0  0
 13 12  1  0  0  0  0
  8  5  2  0  0  0  0
 13 11  2  0  0  0  0
M  END
>  <ID> (BBL000016)
BBL000016

>  <Rotatable_Bonds> (BBL000016)
1

>  <logP> (BBL000016)
2.425

>  <PSA> (BBL000016)
49.66

>  <H_Donors> (BBL000016)
1

>  <H_Acceptors> (BBL000016)
2

>  <Number_of_rings> (BBL000016)
2

>  <NAME> (BBL000016)
1-nitrosonaphthalen-2-ol

>  <Mol_Weight> (BBL000016)
173.17

>  <Mol_Formula> (BBL000016)
C10H7NO2

>  <Smiles> (BBL000016)
O=Nc1c(O)ccc2c1cccc2

>  <CAS_Number> (BBL000016)
131-91-9

>  <Alternative_identifier> (BBL000016)
MFCD00003884

$$$$