Molecule FYI-1001387

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Molecule Summary:

ID: FYI-1001387
SMILES: CC1=CC(=CC=C1)NC(=O)OC2=CC=CC(=C2)NC(=O)OC

Received at FYIcenter.com on: 2022-06-24

Molecule ID: FYI-1001387 Edit

Molecule Structure SMILES String: CC1=CC(=CC=C1)NC(=O)OC2=CC=CC(=C2)NC(=O)OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1001387
FYIcenter.com

 22 23  0  0  0  0  0  0  0  0999 V2000
   10.9120    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 N   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
    3.6373    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  7  2  1  0  0  0  0
  8  4  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11  9  1  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
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
 17 12  1  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001387-3D
FYIcenter.com

 38 39  0  0  0  0  0  0  0  0999 V2000
   -4.2419    4.0047    6.4037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6248    3.5549    5.0241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8380    3.9193    3.9227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1751    3.5272    2.6243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3217    2.7489    2.4344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1109    2.3720    3.5277 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7647    2.7753    4.8171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4380    3.9153    1.4855 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3213    4.7167    1.4630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6662    5.0950    2.4252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0559    5.0951    0.1487 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2648    6.2514    0.0306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1710    6.2151   -0.8274 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5955    7.3667   -0.9889 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2535    8.5448   -0.3147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8671    8.5947    0.5191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6287    7.4359    0.6873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2895    9.7580    1.1883 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7414   11.0067    1.1095 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2445   11.3529    0.4736 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4883   11.8669    1.8557 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0105   13.2129    1.7927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3391    4.6257    6.3855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0383    3.1393    7.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0453    4.6033    6.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9616    4.5293    4.1157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6238    2.4275    1.4422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0019    1.7685    3.3737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3877    2.4818    5.6595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7999    3.6635    0.5777 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0912    5.3071   -1.3612 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4645    7.3616   -1.6433 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8892    9.4118   -0.4677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5016    7.4424    1.3331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1112    9.7028    1.7776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6810   13.8461    2.3794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0133   13.5747    0.7587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0046   13.2805    2.2206 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 23  1  0  0  0  0
  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 26  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 27  1  0  0  0  0
  6  7  2  0  0  0  0
  6 28  1  0  0  0  0
  7 29  1  0  0  0  0
  8  9  1  0  0  0  0
  8 30  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 13 31  1  0  0  0  0
 14 15  2  0  0  0  0
 14 32  1  0  0  0  0
 15 16  1  0  0  0  0
 15 33  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 34  1  0  0  0  0
 18 19  1  0  0  0  0
 18 35  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 36  1  0  0  0  0
 22 37  1  0  0  0  0
 22 38  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2022-07-26, 442👍, 0💬