CDK     1028232202

 12 13  0  0  0  0  0  0  0  0999 V2000
    2.3542    0.7300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1826   -0.0769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7347   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5152   -1.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3222   -1.4045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9632   -1.8461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5771   -2.1891    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2181   -2.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0251   -2.8023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  3  5  1  0  0  0  0 
  3  6  2  0  0  0  0 
  4  7  2  0  0  0  0 
  5  8  2  0  0  0  0 
  6  9  1  0  0  0  0 
  7 10  1  0  0  0  0 
  8 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
  5  7  1  0  0  0  0 
 11 12  1  0  0  0  0 
M  END
> <ID>
CHEBI:200161

> <NAME>
Streptazone B1

> <STAR>
2

> <IUPAC_NAME>
(5Z)-5-ethylidene-2,3-dihydro-1H-cyclopenta[b]pyridin-6-one

> <FORMULA>
C10H11NO

> <MASS>
161.204

> <MONOISOTOPIC_MASS>
161.08406

> <CHARGE>
0

> <SMILES>
O=C1/C(/C2=CCCNC2=C1)=C\C

> <INCHI>
InChI=1S/C10H11NO/c1-2-7-8-4-3-5-11-9(8)6-10(7)12/h2,4,6,11H,3,5H2,1H3/b7-2-

> <INCHIKEY>
RLVWTWCDRCCHFP-UQCOIBPSSA-N

$$$$