
 CHEMBL553520

 33 33  0  0  0  0  0  0  0  0999 V2000
    3.3580   -1.3137    0.4089 C   0  0  0  0  0
    2.5961   -0.0152    0.3331 C   0  0  0  0  0
    3.4705    1.1440    0.2107 N   0  0  0  0  0
    3.9093    1.6910   -0.9334 C   0  0  0  0  0
    3.5035    1.3551   -2.0371 O   0  0  0  0  0
    5.0705    2.6390   -0.6449 C   0  0  0  0  0
    4.9923    4.0818   -1.1986 C   0  0  0  0  0
    5.2342    4.1325   -2.7277 C   0  0  0  0  0
    6.4564    3.4037   -3.1544 N   0  0  0  0  0
    6.4874    2.0206   -2.6421 C   0  0  0  0  0
    6.3790    1.9880   -1.1111 C   0  0  0  0  0
    7.7159    4.1205   -2.8878 C   0  0  0  0  0
    5.0499    2.6303    0.7543 O   0  0  0  0  0
    4.1553    1.7266    1.1989 C   0  0  0  0  0
    4.0259    1.4347    2.3801 O   0  0  0  0  0
   -1.4354    2.0751   -0.3270 Cl  0  0  0  0  0
    2.6565   -2.1722    0.4919 H   0  0  0  0  0
    3.9687   -1.2819    1.3266 H   0  0  0  0  0
    3.9733   -1.4547   -0.5070 H   0  0  0  0  0
    1.9659    0.0857    1.2456 H   0  0  0  0  0
    1.9063   -0.0678   -0.5349 H   0  0  0  0  0
    4.0289    4.5713   -0.9359 H   0  0  0  0  0
    5.8017    4.6732   -0.7178 H   0  0  0  0  0
    4.3606    3.6812   -3.2418 H   0  0  0  0  0
    5.2871    5.1945   -3.0606 H   0  0  0  0  0
    7.4206    1.5074   -2.9557 H   0  0  0  0  0
    5.6601    1.4467   -3.1058 H   0  0  0  0  0
    6.4251    0.9380   -0.7477 H   0  0  0  0  0
    7.2389    2.5237   -0.6603 H   0  0  0  0  0
    7.7361    5.0783   -3.4451 H   0  0  0  0  0
    8.5776    3.5162   -3.2517 H   0  0  0  0  0
    7.8651    4.3274   -1.8091 H   0  0  0  0  0
   -0.1963    2.6877   -0.2848 H   0  0  0  0  0
  1  2  1  0  0  0
  1 17  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  2  3  1  0  0  0
  2 20  1  0  0  0
  2 21  1  0  0  0
  3  4  1  0  0  0
  3 14  1  0  0  0
  4  6  1  0  0  0
  4  5  2  0  0  0
  6  7  1  0  0  0
  6 11  1  0  0  0
  6 13  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
  8 24  1  0  0  0
  8 25  1  0  0  0
  9 10  1  0  0  0
  9 12  1  0  0  0
 10 11  1  0  0  0
 10 26  1  0  0  0
 10 27  1  0  0  0
 11 28  1  0  0  0
 11 29  1  0  0  0
 12 30  1  0  0  0
 12 31  1  0  0  0
 12 32  1  0  0  0
 13 14  1  0  0  0
 14 15  2  0  0  0
 16 33  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL553520

>  <PubChem CID>
45260757

>  <Formula>
C10H17ClN2O3

>  <Molecular Weight>
248.707000

>  <IUPAC Name>
3-ethyl-8-methyl-1-oxa-3,8-diazaspiro[4.5]decane-2,4-dione;hydrochloride

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCN1C(=O)C2(CCN(CC2)C)OC1=O.Cl

>  <Isomeric SMILES>
CCN1C(=O)C2(CCN(CC2)C)OC1=O.Cl

>  <InChI Std. ID>
InChI=1S/C10H16N2O3.ClH/c1-3-12-8(13)10(15-9(12)14)4-6-11(2)7-5-10;/h3-7H2,1-2H3;1H

>  <InChI Key>
LUZFJFYYCHHGIC-UHFFFAOYSA-N

