Molecule Editor

Molecule ID: FYI-1015759 Edit

Molecule Structure InChIKey: CDCHBOQVXIGZHA-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1C=CCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1015759
FYIcenter.com

  6  6  0  0  0  0  0  0  0  0999 V2000
    3.4282    2.3834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    1.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    2.2528    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0694    0.2911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.0000    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
  4  6  2  0  0  0  0
  5  6  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015759-3D
FYIcenter.com

 11 11  0     0  0  0  0  0  0999 V2000
   -2.0245   -0.0248    0.0003 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0495   -1.1248   -0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4296   -0.7349    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3092    0.7480    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8056   -0.0348   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0417    1.1713   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9168   -1.1176   -0.8996 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9162   -1.1175    0.9004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2682   -2.0889   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1627    1.4113    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3191    2.1850   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  2  3  1  0  0  0  0
  2  5  1  0  0  0  0
  2  9  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  6  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  6 11  1  0  0  0  0
M  END
$$$$