Molecule FYI-1001377

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A

Molecule Summary:

ID: FYI-1001377
SMILES: C1=C2C(=CC(=C1Cl)Cl)OC3=CC(=C(C=C3O2)Cl)Cl

Received at FYIcenter.com on: 2022-06-19

Molecule ID: FYI-1001377 Edit

Molecule Structure SMILES String: C1=C2C(=CC(=C1Cl)Cl)OC3=CC(=C(C=C3O2)Cl)Cl

Download SDF Download SVG Structure in 2D SDF:

FYI-1001377
FYIcenter.com

 18 20  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    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
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    8.4000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    9.8000    0.0000 Cl  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  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9  3  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  2  0  0  0  0
 15 10  1  0  0  0  0
 16 15  1  0  0  0  0
 16  2  1  0  0  0  0
 17 13  1  0  0  0  0
 18 12  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001377-3D
FYIcenter.com

 22 24  0  0  0  0  0  0  0  0999 V2000
    2.3665   -1.3749    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1615   -0.6747    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1602    0.7195   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3616    1.4254   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5735    0.7296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5759   -0.6727    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0381   -1.5935    0.0009 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.0303    1.6584   -0.0005 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0005    1.4501   -0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1609    0.7191    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3624    1.4243    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5741    0.7277    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5760   -0.6744    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3660   -1.3759    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1615   -0.6749    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0002   -1.4059   -0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0377   -1.5959    0.0007 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -5.0312    1.6560    0.0010 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3593   -2.4617    0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3482    2.5124   -0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3496    2.5112    0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3585   -2.4629    0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  2  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  4 20  1  0  0  0  0
  5  6  2  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 15  1  0  0  0  0
 11 12  1  0  0  0  0
 11 21  1  0  0  0  0
 12 13  2  0  0  0  0
 12 18  1  0  0  0  0
 13 14  1  0  0  0  0
 13 17  1  0  0  0  0
 14 15  2  0  0  0  0
 14 22  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2022-07-26, 1962👍, 0💬