Molecule Editor

Molecule ID: FYI-1016033 Edit

Molecule Structure InChIKey: PSAKKOKLSDIKEK-UHFFFAOYSA-N

Molecule Structure SMILES String: NC(=O)C(F)(F)Cl

Download SDF Download SVG Structure in 2D SDF:

FYI-1016033
FYIcenter.com

  7  6  0  0  0  0  0  0  0  0999 V2000
    3.1250    2.4248    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.3124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.5124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.7249    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  3  1  0  0  0  0
  6  2  1  0  0  0  0
  7  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016033-3D
FYIcenter.com

  9  8  0     0  0  0  0  0  0999 V2000
   -1.2649    0.0073    1.5266 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0766    1.0610   -0.8025 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0071   -1.1142   -0.7689 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.5138    1.1386    0.0654 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5146   -1.1619    0.0790 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5882   -0.0019   -0.1099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9084    0.0710    0.0103 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5216   -1.2455    0.1699 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9853   -2.0271    0.0389 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  6  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
$$$$