Molecule Editor

Molecule ID: FYI-1007351 Edit

Molecule Structure InChIKey: UWPGNGCMIAWYKT-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)Cc1ccc(C(C)C(=O)O)cc1C(=O)c2ccccc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1007351
FYIcenter.com

 23 24  0  0  0  0  0  0  0  0999 V2000
    9.6994    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0623    6.2999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2126    7.7003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    6.3003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
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  6 16  1  0  0  0  0
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 22 23  2  0  0  0  0
 18 23  1  0  0  0  0
 18 19  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007351-3D
FYIcenter.com

 45 46  0  0  1  0  0  0  0  0999 V2000
    2.7293    0.2060    3.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3249    0.2986    1.5352 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8355    0.6181    1.3807 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1316    1.3451    0.7644 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6142    1.0441    0.7119 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3874    1.9329    1.4902 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7593    1.8472    1.5191 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4050    0.8857    0.7435 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9227    0.9837    0.7013 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.5444    0.2350    1.8798 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5483    0.6192   -0.6329 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.6408   -0.0624    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4335   -0.9474   -0.9268 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$