PNU-120596.cdx
csChFnd80/01311310532D

 21 22  0  0  0  0  0  0  0  0999 V2000
    7.2279    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2279    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4404    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6528    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6528    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4404    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0197    4.8927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8610    4.8927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0693    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8610    2.0976    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.8115    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0197    2.0976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0197    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8115    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2279    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6032    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4569    2.0899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0875    2.3810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3875    1.1685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3243    0.1281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  4 10  1  0  0  0  0
  7 11  1  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 16  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <Mol_ID> (1)
960

>  <Formula> (1)
C13H14ClN3O4

>  <MolWeight> (1)
311.72096

>  <Item Name> (1)
PNU-120596

>  <Catalog Number> (1)
S2629

>  <Synonyms> (1)
N/A 

>  <Target> (1)
AChR

>  <URL> (1)
http://www.selleckchem.com/products/pnu120596.html

>  <CAS Number> (1)
501925-31-1

$$$$
