Molecule FYI-1008709

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Molecule Summary:

ID: FYI-1008709
Names:
InChIKey: UOZOLZSKMCSZIW-UHFFFAOYSA-N
SMILES: CCC(C)NC(=O)CCN

Received at FYIcenter.com on: 2024-04-28

Molecule ID: FYI-1008709 Edit

Molecule Structure InChIKey: UOZOLZSKMCSZIW-UHFFFAOYSA-N

Molecule Structure SMILES String: CCC(C)NC(=O)CCN

Download SDF Download SVG Structure in 2D SDF:

FYI-1008709
FYIcenter.com

 10  9  0  0  0  0  0  0  0  0999 V2000
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008709-3D
FYIcenter.com

 26 25  0     1  0  0  0  0  0999 V2000
    0.6784    1.0353   -1.2036 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063   -0.0519    0.3942 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2122   -0.6361    0.4447 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8830    0.4413   -0.0641 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.9738   -0.5891    0.2428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1656    1.7694    0.6282 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5840    0.2954   -0.2280 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7797   -0.3534    0.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7221   -1.9300   -0.4346 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0965    0.0192   -0.2264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8321    0.6097   -1.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9438   -0.2019   -0.0919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0516   -0.7521    1.3251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5778   -0.6175    1.2382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1948    1.6543    1.7178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3906    2.5082    0.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1276    2.1797    0.3039 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7890   -0.0393    1.4979 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6356   -1.4408    0.4212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8142   -2.4104   -0.0571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5598   -2.6087   -0.2444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6245   -1.8092   -1.5182 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2421    1.1050   -0.2022 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0825   -0.2845   -1.2789 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2527   -0.3351    1.4177 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0872   -0.3367    0.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  2  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  2 14  1  0  0  0  0
  3 10  1  0  0  0  0
  3 25  1  0  0  0  0
  3 26  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 11  1  0  0  0  0
  5  9  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  8 10  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
 10 23  1  0  0  0  0
 10 24  1  0  0  0  0
M  END
$$$$

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2024-04-29, 859👍, 0💬