
 OpenBabel04291915403D

 50 55  0  0  1  0  0  0  0  0999 V2000
    3.4910    6.4178   -0.0908 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9526    6.7113    0.2058 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.0640    8.0185    0.8951 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2438    8.4762    1.2490 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3105    8.3912   -0.0932 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.1963    7.0505   -0.8001 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.7347    6.7570   -1.0967 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.6233    5.4498   -1.7860 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9687    4.5429   -1.2799 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2629    5.2496   -3.0111 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0076    6.2813   -3.5868 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0998    7.3641   -3.0159 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1580    4.0178   -3.6606 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7731    3.8253   -4.8387 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6722    2.6408   -5.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2873    2.4483   -6.6414 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0033    3.4404   -7.1950 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4419    3.0257   -3.1070 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1787    1.1746   -7.3130 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5242    0.2677   -6.8070 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8184    0.9744   -8.5382 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7134   -0.2574   -9.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3286   -0.4498  -10.3658 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2276   -1.6344  -10.9903 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8427   -1.8269  -12.1685 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7418   -3.0114  -12.7930 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3684   -5.9126  -17.5173 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7735   -5.7265  -16.3779 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.8711   -4.5809  -15.7739 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2560   -4.3884  -14.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3569   -3.2039  -13.9712 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6762    6.6692    0.5555 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7700    5.8302   -0.6198 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3506    5.9418    0.8339 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2150    8.5694    1.0970 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4902    8.8309    2.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1302    9.0592   -0.2574 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0105    6.6881   -0.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3367    7.5264   -1.7249 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3234    4.5877   -5.2642 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1219    1.8784   -5.0379 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5990    3.9027   -7.8997 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8463    2.5634   -2.4024 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3433    1.7018   -8.9440 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8788    0.3126  -10.7912 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6774   -2.3968  -10.5649 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3930   -1.0645  -12.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4214   -3.8185  -16.1993 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7057   -5.1508  -14.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9072   -2.4415  -14.3966 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  2 34  1  0  0  0  0
  3  4  2  0  0  0  0
  3 35  1  0  0  0  0
  4  5  1  0  0  0  0
  4 36  1  0  0  0  0
  5  6  1  0  0  0  0
  5 37  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  1  0  0  0  0
  6 38  1  0  0  0  0
  7  8  1  0  0  0  0
  7 39  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  2  0  0  0  0
 10 13  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 13 14  2  0  0  0  0
 13 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 40  1  0  0  0  0
 15 16  2  0  0  0  0
 15 41  1  0  0  0  0
 16 19  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 42  1  0  0  0  0
 18 43  1  0  0  0  0
 19 21  1  0  0  0  0
 19 20  2  0  0  0  0
 21 22  1  0  0  0  0
 21 44  1  0  0  0  0
 22 23  2  0  0  0  0
 22 27  1  0  0  0  0
 23 24  1  0  0  0  0
 23 45  1  0  0  0  0
 24 25  2  0  0  0  0
 24 46  1  0  0  0  0
 25 26  1  0  0  0  0
 25 47  1  0  0  0  0
 26 31  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 48  1  0  0  0  0
 30 31  2  0  0  0  0
 30 49  1  0  0  0  0
 31 50  1  0  0  0  0
M  END
>  <SKU>
A12737

>  <Product Name>
IWR-1-endo

>  <CAS>
1127442-82-3

>  <M.Wt>
409.43666

>  <Formula>
C25H19N3O3

>  <Synonyms>
N/A

>  <URL>
https://www.adooq.com/iwr-1-endo.html

$$$$
