Molecule Editor

Molecule ID: FYI-1003964 Edit

Molecule Structure InChIKey: ZABMHLDQFJHDSC-UHFFFAOYSA-N

Molecule Structure SMILES String: C1=COCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003964
FYIcenter.com

  5  5  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.4326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3316    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1543    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3316    2.2652    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  5  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003964-3D
FYIcenter.com

 10 10  0     0  0  0  0  0  0999 V2000
   -1.1893    0.3538    0.0002 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7730   -0.8896    0.0003 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6647   -1.0090   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1042    0.4199   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0231    1.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0256   -1.5209   -0.8980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0262   -1.5217    0.8967 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4411   -1.6464   -0.0032 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1292    0.7484   -0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1740    2.1883   -0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  5  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  8  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
M  END
$$$$