Molecule Editor

Molecule ID: FYI-1002195 Edit

Molecule Structure InChIKey: ZNSQICMTTCTJBW-JSKKQJDMSA-N

Molecule Structure SMILES String: Cc6ccc(C3C(N(=O)=O)C(c1ccccc1)C2CCCCC2(O)C35C(=O)c4ccccc4C5=O)cc6

Download SDF Download SVG Structure in 2D SDF:

FYI-1002195
FYIcenter.com

 41 46  0  0  0  0  0  0  0  0999 V2000
    6.7406    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5282    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1033    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5282    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9531    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1655    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1694    5.5923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7482    3.0833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    7.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    7.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.8834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    4.6710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4596    3.6073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    1.4000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5283   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7408   11.1999    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3159   11.2001    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5284   11.9000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  6  7  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  7 12  1  0  0  0  0
  7  8  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 10 16  1  0  0  0  0
  9 13  1  0  0  0  0
 11 17  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 17 22  1  0  0  0  0
 17 18  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  8 26  1  0  0  0  0
  8 23  1  0  0  0  0
 12 27  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  2  0  0  0  0
 23 30  2  0  0  0  0
 26 31  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 25 35  2  0  0  0  0
 24 32  2  0  0  0  0
  9 36  1  0  0  0  0
 10 37  1  1  0  0  0
  3 38  1  0  0  0  0
 38 39  1  0  0  0  0
 38 40  1  0  0  0  0
 38 41  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002195-3D
FYIcenter.com

 66 71  0  0  1  0  0  0  0  0999 V2000
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    0.7219    0.5642    0.4856 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2537    1.8836    0.6486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1475    2.1931    0.8692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1407    1.1993    0.8927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7651    1.3949    0.7466 C   0  0  3  0  0  0  0  0  0  0  0  0
   -4.4907    2.8548    0.6672 C   0  0  3  0  0  0  0  0  0  0  0  0
   -5.6680    2.9698    1.6308 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1891    4.0882    1.7397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9530    1.9954    2.3386 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8470    3.4704   -0.8255 C   0  0  3  0  0  0  0  0  0  0  0  0
   -6.1806    3.4743   -1.7023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4477    3.8480   -1.2186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6194    3.8180   -2.0308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5694    3.4730   -3.3713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3469    3.1316   -3.9029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2094    3.1330   -3.0707 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1207    3.3999   -4.1279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9882    1.8799   -4.2596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7455    0.9664   -3.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.6098   -1.5713   -0.5213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2493   -2.6767    0.0426 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -8.2582   -2.0491   -1.1628 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.3300   -0.6472   -1.2256 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1257   -0.4540   -0.7626 H   0  0  0  0  0  0  0  0  0  0  0  0
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 22 23  1  0  0  0  0
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 37 66  1  0  0  0  0
M  END
$$$$