8580
  CDK     0416232200

 13 14  0  0  0  0  0  0  0  0999 V2000
    2.0929   -0.2205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -1.4580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -1.0455    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364    0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364    1.0170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -0.2205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219    1.4295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9739   -0.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9739    1.4580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075    0.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075    1.0170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7214    0.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7214    1.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  6  1  0  0  0  0 
  4  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  4  8  2  0  0  0  0 
  5  7  1  0  0  0  0 
  5  9  2  0  0  0  0 
  6 10  2  0  0  0  0 
  7 11  2  0  0  0  0 
  8 12  1  0  0  0  0 
  9 13  1  0  0  0  0 
 10 11  1  0  0  0  0 
 12 13  2  0  0  0  0 
M  END
> <ID>
CHEBI:194993

> <NAME>
1-Nitroso-2-naphthol

> <STAR>
2

> <IUPAC_NAME>
1-nitrosonaphthalen-2-ol

> <FORMULA>
C10H7NO2

> <MASS>
173.171

> <MONOISOTOPIC_MASS>
173.04768

> <CHARGE>
0

> <SMILES>
OC1=C(N=O)C=2C(C=C1)=CC=CC2

> <INCHI>
InChI=1S/C10H7NO2/c12-9-6-5-7-3-1-2-4-8(7)10(9)11-13/h1-6,12H

> <INCHIKEY>
YXAOOTNFFAQIPZ-UHFFFAOYSA-N

$$$$