Molecule FYI-1004623

Molecule Summary:

ID: FYI-1004623
Names:
InChIKey: BBIFXVHLVDNVGO-DXNYSGJVSA-N
SMILES: C/C=C(Nc1ccc(O)c(N)c1)\\O\\N=C(N)\\c2cc(C)on2

Received at FYIcenter.com on: 2023-09-15

Molecule ID: FYI-1004623 Edit

Molecule Structure InChIKey: BBIFXVHLVDNVGO-DXNYSGJVSA-N

Molecule Structure SMILES String: C/C=C(Nc1ccc(O)c(N)c1)\O\N=C(N)\c2cc(C)on2

Download SDF Download SVG Structure in 2D SDF:

FYI-1004623
FYIcenter.com

 22 23  0  0  0  0  0  0  0  0999 V2000
    9.6704    5.2754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2780    5.1291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3412    6.1694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    5.6000    0.0000 C   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    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.2000    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    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2086    4.2077    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5780    3.9167    0.0000 O   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  1  0  0  0  0
  6  5  1  0  0  0  0
  7  5  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 13  2  0  0  0  0
 16 15  1  0  0  0  0
 17 15  1  0  0  0  0
 18 17  2  0  0  0  0
 18 11  1  0  0  0  0
 19  9  2  0  0  0  0
 20 19  1  0  0  0  0
 21  4  2  0  0  0  0
 22 21  1  0  0  0  0
 22  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004623-3D
FYIcenter.com

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