
 OpenBabel04291915383D

 40 42  0  0  0  0  0  0  0  0999 V2000
   -7.3767   -7.8025    9.1163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1177   -6.9632    8.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4164   -6.9624    8.1459 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0658   -6.2270    7.2950 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4087   -6.2261    7.2957 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0802   -5.4656    6.4158 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4231   -5.4648    6.4165 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0945   -4.7043    5.5366 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3943   -5.4673    6.4143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0514   -5.4682    6.4136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4462   -6.2036    7.2646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3532   -4.6782    5.4978 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9567   -4.6791    5.4971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3429   -5.3743    6.3014 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2584   -3.8892    4.5813 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8619   -3.8901    4.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1904   -3.1304    3.6999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8475   -3.1304    3.6999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1761   -3.8901    4.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1669   -3.8901    4.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2048   -3.8901    4.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0379   -4.8733    5.7247 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.8649   -2.3673    2.8153 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1714   -1.5828    1.9057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0720   -8.3336    9.7322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7608   -7.1787    9.7298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7622   -8.5012    8.5879 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9247   -6.8099    7.9725 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5642   -4.8819    5.7391 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9391   -6.0485    7.0933 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9193   -4.2983    5.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4143   -6.2144    7.2757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8454   -4.1207    4.8528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7507   -3.3317    3.9362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3315   -2.5467    3.0231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6921   -4.4738    5.2573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2368   -3.8901    4.5805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8668   -1.0516    1.2899 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5563   -2.2073    1.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5563   -0.8842    2.4334 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 25  1  0  0  0  0
  1 26  1  0  0  0  0
  1 27  1  0  0  0  0
  2  3  2  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5 28  1  0  0  0  0
  6  7  2  0  0  0  0
  6 29  1  0  0  0  0
  7  8  1  0  0  0  0
  7 30  1  0  0  0  0
  8  9  2  0  0  0  0
  8 31  1  0  0  0  0
  9 10  1  0  0  0  0
 10 12  1  0  0  0  0
 10 11  2  0  0  0  0
 11 32  1  0  0  0  0
 12 13  1  0  0  0  0
 12 33  1  0  0  0  0
 13 15  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  1  0  0  0  0
 15 34  1  0  0  0  0
 16 17  2  0  0  0  0
 16 21  1  0  0  0  0
 17 23  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 35  1  0  0  0  0
 19 20  1  0  0  0  0
 19 36  1  0  0  0  0
 20 22  1  0  0  0  0
 20 21  2  0  0  0  0
 21 37  1  0  0  0  0
 23 24  1  0  0  0  0
 24 38  1  0  0  0  0
 24 39  1  0  0  0  0
 24 40  1  0  0  0  0
M  END
>  <SKU>
A11951

>  <Product Name>
PQ 401

>  <CAS>
196868-63-0

>  <M.Wt>
341.79154

>  <Formula>
C18H16ClN3O2

>  <Synonyms>
PQ401

>  <URL>
https://www.adooq.com/pq-401.html

$$$$
