
 IDAZOXAN

 27 29  0  0  0  0  0  0  0  0999 V2000
   -1.0133    0.2215    0.9972 C   0  0  0  0  0
   -0.5241   -0.9032    0.0780 C   0  0  0  0  0
    0.7280   -0.4071   -0.5667 N   0  0  0  0  0
    1.0425    0.6575    0.1300 C   0  0  0  0  0
    0.2027    0.9770    1.1731 N   0  0  0  0  0
    2.2652    1.4944   -0.2002 C   0  0  0  0  0
    3.4661    0.9327    0.5450 C   0  0  0  0  0
    4.6544    1.6695    0.2251 O   0  0  0  0  0
    4.4280    3.0215    0.2482 C   0  0  0  0  0
    5.5532    3.8434    0.2613 C   0  0  0  0  0
    5.4024    5.2305    0.3043 C   0  0  0  0  0
    4.1250    5.7935    0.3315 C   0  0  0  0  0
    2.9977    4.9719    0.3055 C   0  0  0  0  0
    3.1483    3.5869    0.2493 C   0  0  0  0  0
    1.9967    2.8440    0.2063 O   0  0  0  0  0
   -1.7708    0.8335    0.4963 H   0  0  0  0  0
   -1.4134   -0.1546    1.9422 H   0  0  0  0  0
   -1.2734   -1.1517   -0.6798 H   0  0  0  0  0
   -0.2909   -1.8082    0.6502 H   0  0  0  0  0
    0.1289    1.9677    1.3882 H   0  0  0  0  0
    2.4244    1.4809   -1.2863 H   0  0  0  0  0
    3.6425   -0.1129    0.2700 H   0  0  0  0  0
    3.3232    0.9666    1.6333 H   0  0  0  0  0
    6.5466    3.4030    0.2476 H   0  0  0  0  0
    6.2803    5.8709    0.3198 H   0  0  0  0  0
    4.0092    6.8741    0.3676 H   0  0  0  0  0
    2.0042    5.4112    0.3160 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2  3  1  0  0  0
  2 18  1  0  0  0
  2 19  1  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  5 20  1  0  0  0
  6  7  1  0  0  0
  6 15  1  0  0  0
  6 21  1  0  0  0
  7  8  1  0  0  0
  7 22  1  0  0  0
  7 23  1  0  0  0
  8  9  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 10 24  1  0  0  0
 11 12  2  0  0  0
 11 25  1  0  0  0
 12 13  1  0  0  0
 12 26  1  0  0  0
 13 14  2  0  0  0
 13 27  1  0  0  0
 14 15  1  0  0  0
M  END

>  <Chemical Name>
IDAZOXAN

>  <PubChem CID>
54459

>  <Formula>
C11H12N2O2

>  <Molecular Weight>
204.229000

>  <IUPAC Name>
2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4,5-dihydro-1H-imidazole

>  <XlogP>
0.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CN=C(N1)C2COC3=CC=CC=C3O2

>  <Isomeric SMILES>
C1CN=C(N1)C2COC3=CC=CC=C3O2

>  <InChI Std. ID>
InChI=1S/C11H12N2O2/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10H,5-7H2,(H,12,13)

>  <InChI Key>
HPMRFMKYPGXPEP-UHFFFAOYSA-N

