Molecule FYI-1002309

Home > Molecule

A

Molecule Summary:

ID: FYI-1002309
Names:
InChIKey: JZCQSVMJJVFPOF-UHFFFAOYSA-N
SMILES: CNC(=O)NP(=O)(N1CC1)N2CC2

Received at FYIcenter.com on: 2023-02-23

Molecule ID: FYI-1002309 Edit

Molecule Structure InChIKey: JZCQSVMJJVFPOF-UHFFFAOYSA-N

Molecule Structure SMILES String: CNC(=O)NP(=O)(N1CC1)N2CC2

Download SDF Download SVG Structure in 2D SDF:

FYI-1002309
FYIcenter.com

 13 14  0  0  0  0  0  0  0  0999 V2000
    1.5420    7.2044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3248    6.0437    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9317    7.3739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4027    4.6459    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.7974    4.7678    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5982    5.9161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8748    4.5437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3710    3.2462    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3323    2.3075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0080    4.5239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6258    0.9387    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5871    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  2  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  5  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  4 10  2  0  0  0  0
  9 11  1  0  0  0  0
  9 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002309-3D
FYIcenter.com

 26 27  0  0  0  0  0  0  0  0999 V2000
    1.7491    1.3703   -0.4334 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9784    0.6230   -0.3285 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6303    0.1877   -1.4511 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3364    0.4968   -2.5983 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6131   -0.6926   -1.1449 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5031   -1.4456   -2.4900 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.7157   -1.4907   -1.5427 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5256   -2.8544   -2.3754 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9917   -3.3718   -1.1141 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1214   -4.0677   -1.8035 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3931   -2.1987   -3.8351 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2871   -1.3339   -4.5954 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0713   -1.9814   -5.2252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5057    1.7775    0.5506 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9548    0.6943   -0.7617 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8657    2.1766   -1.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0634    0.0129    0.4742 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2123   -0.5466   -0.3517 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9986   -3.7977   -1.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2208   -2.8759   -0.1805 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9095   -4.9922   -2.3233 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1077   -3.9885   -1.3625 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2672   -1.7532   -4.7618 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2503   -0.2679   -4.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2363   -2.8404   -5.8686 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2120   -1.3766   -5.4596 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  6 11  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
 10 21  1  0  0  0  0
 10 22  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 13  1  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-03-17, 404👍, 0💬