
 clonidine

 23 24  0  0  0  0  0  0  0  0999 V2000
    0.6691   -1.6709   -0.1255 C   0  0  0  0  0
   -0.3121   -1.3886    1.0140 C   0  0  0  0  0
   -0.6031    0.0700    0.9647 N   0  0  0  0  0
    0.2520    0.5423    0.1038 C   0  0  0  0  0
    1.1403   -0.3380   -0.4424 N   0  0  0  0  0
    0.4082    1.8090   -0.3622 N   0  0  0  0  0
   -0.4806    2.8892   -0.1284 C   0  0  0  0  0
    0.0514    4.1504    0.2268 C   0  0  0  0  0
   -0.7665    5.2638    0.4506 C   0  0  0  0  0
   -2.1461    5.1443    0.3360 C   0  0  0  0  0
   -2.6999    3.9189   -0.0280 C   0  0  0  0  0
   -1.8812    2.8053   -0.2735 C   0  0  0  0  0
   -2.6818    1.4110   -0.9223 Cl  0  0  0  0  0
    1.7662    4.3728    0.3712 Cl  0  0  0  0  0
    1.4822   -2.3343    0.1774 H   0  0  0  0  0
    0.1516   -2.1037   -0.9897 H   0  0  0  0  0
    0.1238   -1.6404    1.9844 H   0  0  0  0  0
   -1.2357   -1.9637    0.8878 H   0  0  0  0  0
    1.3129   -0.1745   -1.4277 H   0  0  0  0  0
    1.3800    2.1035   -0.3358 H   0  0  0  0  0
   -0.3303    6.2243    0.7098 H   0  0  0  0  0
   -2.7882    6.0043    0.5032 H   0  0  0  0  0
   -3.7790    3.8367   -0.1470 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  1  0  0  0
  1 15  1  0  0  0
  1 16  1  0  0  0
  2  3  1  0  0  0
  2 17  1  0  0  0
  2 18  1  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  5 19  1  0  0  0
  6  7  1  0  0  0
  6 20  1  0  0  0
  7  8  2  0  0  0
  7 12  1  0  0  0
  8  9  1  0  0  0
  8 14  1  0  0  0
  9 10  2  0  0  0
  9 21  1  0  0  0
 10 11  1  0  0  0
 10 22  1  0  0  0
 11 12  2  0  0  0
 11 23  1  0  0  0
 12 13  1  0  0  0
M  END

>  <Chemical Name>
clonidine

>  <PubChem CID>
2803

>  <Formula>
C9H9Cl2N3

>  <Molecular Weight>
230.092000

>  <IUPAC Name>
N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine

>  <XlogP>
1.600

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl

>  <Isomeric SMILES>
C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl

>  <InChI Std. ID>
InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)

>  <InChI Key>
GJSURZIOUXUGAL-UHFFFAOYSA-N

