
 GR196429

 36 38  0  0  0  0  0  0  0  0999 V2000
    6.2605   -1.3769   -3.6585 C   0  0  0  0  0
    5.9163   -0.5664   -2.4387 C   0  0  0  0  0
    4.8002   -0.0852   -2.2673 O   0  0  0  0  0
    6.9595   -0.4075   -1.5621 N   0  0  0  0  0
    6.8473    0.4506   -0.3971 C   0  0  0  0  0
    7.9102    0.1139    0.6549 C   0  0  0  0  0
    9.2565    0.2649    0.1002 N   0  0  0  0  0
    9.8506    1.6247    0.0888 C   0  0  0  0  0
   11.3914    1.4140   -0.0346 C   0  0  0  0  0
   11.5616   -0.0755    0.1334 C   0  0  0  0  0
   10.2843   -0.6823    0.2038 C   0  0  0  0  0
   10.3414   -2.0723    0.3584 C   0  0  0  0  0
   11.6216   -2.6307    0.4111 C   0  0  0  0  0
   12.8517   -2.0045    0.3605 C   0  0  0  0  0
   12.8230   -0.6428    0.2079 C   0  0  0  0  0
   11.5688   -4.0141    0.5481 O   0  0  0  0  0
   10.1802   -4.3653    0.3128 C   0  0  0  0  0
    9.3125   -3.1136    0.4713 C   0  0  0  0  0
    7.0192   -2.1290   -3.4255 H   0  0  0  0  0
    6.6326   -0.7112   -4.4407 H   0  0  0  0  0
    5.3647   -1.8946   -4.0132 H   0  0  0  0  0
    7.9063   -0.6204   -1.8594 H   0  0  0  0  0
    5.8455    0.3452    0.0346 H   0  0  0  0  0
    6.9557    1.4838   -0.7447 H   0  0  0  0  0
    7.7473   -0.9120    1.0020 H   0  0  0  0  0
    7.7869    0.7636    1.5295 H   0  0  0  0  0
    9.4660    2.2137   -0.7500 H   0  0  0  0  0
    9.6252    2.1535    1.0223 H   0  0  0  0  0
   11.9306    1.9656    0.7414 H   0  0  0  0  0
   11.7488    1.7172   -1.0241 H   0  0  0  0  0
   13.7703   -2.5710    0.4297 H   0  0  0  0  0
   13.7256   -0.0466    0.1492 H   0  0  0  0  0
    9.8848   -5.1563    1.0091 H   0  0  0  0  0
   10.1087   -4.7641   -0.7069 H   0  0  0  0  0
    8.8547   -3.0759    1.4642 H   0  0  0  0  0
    8.5420   -3.0429   -0.2999 H   0  0  0  0  0
  1  2  1  0  0  0
  1 19  1  0  0  0
  1 20  1  0  0  0
  1 21  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  4  5  1  0  0  0
  4 22  1  0  0  0
  5  6  1  0  0  0
  5 23  1  0  0  0
  5 24  1  0  0  0
  6  7  1  0  0  0
  6 25  1  0  0  0
  6 26  1  0  0  0
  7  8  1  0  0  0
  7 11  1  0  0  0
  8  9  1  0  0  0
  8 27  1  0  0  0
  8 28  1  0  0  0
  9 10  1  0  0  0
  9 29  1  0  0  0
  9 30  1  0  0  0
 10 15  1  0  0  0
 10 11  2  0  0  0
 11 12  1  0  0  0
 12 13  2  0  0  0
 12 18  1  0  0  0
 13 14  1  0  0  0
 13 16  1  0  0  0
 14 15  2  0  0  0
 14 31  1  0  0  0
 15 32  1  0  0  0
 16 17  1  0  0  0
 17 18  1  0  0  0
 17 33  1  0  0  0
 17 34  1  0  0  0
 18 35  1  0  0  0
 18 36  1  0  0  0
M  END

>  <Chemical Name>
GR196429

>  <PubChem CID>
5311134

>  <Formula>
C14H18N2O2

>  <Molecular Weight>
246.310000

>  <IUPAC Name>
N-[2-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)ethyl]acetamide

>  <XlogP>
1.4

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(=O)NCCN1CCC2=C1C3=C(C=C2)OCC3

>  <Isomeric SMILES>
CC(=O)NCCN1CCC2=C1C3=C(C=C2)OCC3

>  <InChI Std. ID>
InChI=1S/C14H18N2O2/c1-10(17)15-6-8-16-7-4-11-2-3-13-12(14(11)16)5-9-18-13/h2-3H,4-9H2,1H3,(H,15,17)

>  <InChI Key>
LTYWTNUOUBBVNZ-UHFFFAOYSA-N

