Molecule Editor

Molecule ID: FYI-1005544 Edit

Molecule Structure InChIKey: HUFDRQJZVCFXDB-UHFFFAOYSA-N

Molecule Structure SMILES String: c2cc1cc1c2

Download SDF Download SVG Structure in 2D SDF:

FYI-1005544
FYIcenter.com

  6  7  0  0  0  0  0  0  0  0999 V2000
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005544-3D
FYIcenter.com

 10 11  0     0  0  0  0  0  0999 V2000
   -0.6388   -0.7656    0.2607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6389    0.7648    0.2618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6030    0.0002   -0.3672 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7081   -1.0938    0.0182 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7073    1.0941    0.0177 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4653    0.0003   -0.1913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6515   -0.0003   -0.1276 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0990   -2.0945    0.1222 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0978    2.0949    0.1216 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5313    0.0006   -0.3400 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  3  1  0  0  0  0
  2  5  2  0  0  0  0
  3  7  1  0  0  0  0
  4  6  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
M  END
$$$$