
 RS-86

 35 35  0  0  0  0  0  0  0  0999 V2000
    3.1222   -0.6220    0.6129 C   0  0  0  0  0
    2.2548    0.0237   -0.4654 C   0  0  0  0  0
    2.6153    1.4173   -0.6980 N   0  0  0  0  0
    3.5262    1.8242   -1.5903 C   0  0  0  0  0
    4.1253    1.0549   -2.3278 O   0  0  0  0  0
    3.7436    3.3032   -1.5857 C   0  0  0  0  0
    2.7541    3.7844   -0.4536 C   0  0  0  0  0
    2.1384    2.4733   -0.0194 C   0  0  0  0  0
    1.2993    2.3722    0.8655 O   0  0  0  0  0
    1.6803    4.7579   -0.9830 C   0  0  0  0  0
    2.3215    6.0980   -1.3990 C   0  0  0  0  0
    3.0944    6.7222   -0.3011 N   0  0  0  0  0
    4.1037    5.8053    0.2748 C   0  0  0  0  0
    3.4921    4.4620    0.7222 C   0  0  0  0  0
    2.2415    7.3528    0.7178 C   0  0  0  0  0
    2.8749    1.5951    4.1666 Br  0  0  0  0  0
    2.8002   -1.6765    0.7604 H   0  0  0  0  0
    3.0152   -0.0894    1.5819 H   0  0  0  0  0
    4.1863   -0.6222    0.3003 H   0  0  0  0  0
    1.1915   -0.0368   -0.1447 H   0  0  0  0  0
    2.3452   -0.5602   -1.4061 H   0  0  0  0  0
    4.8100    3.5027   -1.3455 H   0  0  0  0  0
    3.4877    3.6994   -2.5905 H   0  0  0  0  0
    1.1403    4.3112   -1.8460 H   0  0  0  0  0
    0.9297    4.9494   -0.1862 H   0  0  0  0  0
    3.0037    5.9294   -2.2584 H   0  0  0  0  0
    1.5312    6.7919   -1.7609 H   0  0  0  0  0
    4.6193    6.2854    1.1354 H   0  0  0  0  0
    4.8871    5.6198   -0.4894 H   0  0  0  0  0
    4.2896    3.7969    1.1200 H   0  0  0  0  0
    2.7762    4.6511    1.5513 H   0  0  0  0  0
    1.5906    8.1170    0.2424 H   0  0  0  0  0
    2.8724    7.8814    1.4639 H   0  0  0  0  0
    1.6041    6.6155    1.2453 H   0  0  0  0  0
    1.6938    0.8446    3.5510 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  8  1  0  0  0
  4  6  1  0  0  0
  4  5  2  0  0  0
  6  7  1  0  0  0
  6 22  1  0  0  0
  6 23  1  0  0  0
  7 10  1  0  0  0
  7 14  1  0  0  0
  7  8  1  0  0  0
  8  9  2  0  0  0
 10 11  1  0  0  0
 10 24  1  0  0  0
 10 25  1  0  0  0
 11 12  1  0  0  0
 11 26  1  0  0  0
 11 27  1  0  0  0
 12 13  1  0  0  0
 12 15  1  0  0  0
 13 14  1  0  0  0
 13 28  1  0  0  0
 13 29  1  0  0  0
 14 30  1  0  0  0
 14 31  1  0  0  0
 15 32  1  0  0  0
 15 33  1  0  0  0
 15 34  1  0  0  0
 16 35  1  0  0  0
M  END

>  <Chemical Name>
RS-86

>  <PubChem CID>
87933

>  <Formula>
C11H19BrN2O2

>  <Molecular Weight>
291.189000

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

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CCN1C(=O)CC2(C1=O)CCN(CC2)C.Br

>  <Isomeric SMILES>
CCN1C(=O)CC2(C1=O)CCN(CC2)C.Br

>  <InChI Std. ID>
InChI=1S/C11H18N2O2.BrH/c1-3-13-9(14)8-11(10(13)15)4-6-12(2)7-5-11;/h3-8H2,1-2H3;1H

>  <InChI Key>
RKVCNLSYEWDGNX-UHFFFAOYSA-N

