
 luzindole

 42 44  0  0  0  0  0  0  0  0999 V2000
    4.6251    5.3702    2.8926 C   0  0  0  0  0
    4.2480    4.2881    1.9169 C   0  0  0  0  0
    3.4152    4.4684    1.0343 O   0  0  0  0  0
    4.8962    3.0943    2.1241 N   0  0  0  0  0
    4.7098    1.9580    1.2386 C   0  0  0  0  0
    5.4356    2.0946   -0.1049 C   0  0  0  0  0
    6.9269    2.2144    0.0372 C   0  0  0  0  0
    7.6704    3.3873    0.0480 C   0  0  0  0  0
    8.9903    3.0413    0.2171 N   0  0  0  0  0
    9.1340    1.6763    0.2431 C   0  0  0  0  0
   10.2926    0.8962    0.3357 C   0  0  0  0  0
   10.1419   -0.4925    0.3126 C   0  0  0  0  0
    8.8804   -1.0741    0.2105 C   0  0  0  0  0
    7.7320   -0.2772    0.1273 C   0  0  0  0  0
    7.8572    1.1276    0.1380 C   0  0  0  0  0
    7.2591    4.8227   -0.1089 C   0  0  0  0  0
    8.0451    5.5745   -1.1639 C   0  0  0  0  0
    8.2750    5.0174   -2.4322 C   0  0  0  0  0
    8.9884    5.7234   -3.4014 C   0  0  0  0  0
    9.4607    7.0038   -3.1234 C   0  0  0  0  0
    9.2169    7.5798   -1.8782 C   0  0  0  0  0
    8.5105    6.8713   -0.9041 C   0  0  0  0  0
    5.5804    5.1577    3.3811 H   0  0  0  0  0
    3.8444    5.4537    3.6535 H   0  0  0  0  0
    4.7216    6.3199    2.3580 H   0  0  0  0  0
    5.6941    3.0669    2.7460 H   0  0  0  0  0
    3.6352    1.8388    1.0575 H   0  0  0  0  0
    5.0600    1.0728    1.7811 H   0  0  0  0  0
    5.0439    2.9554   -0.6581 H   0  0  0  0  0
    5.2055    1.2146   -0.7185 H   0  0  0  0  0
    9.7589    3.6979    0.2378 H   0  0  0  0  0
   11.2764    1.3477    0.4083 H   0  0  0  0  0
   11.0233   -1.1273    0.3692 H   0  0  0  0  0
    8.7856   -2.1572    0.1855 H   0  0  0  0  0
    6.7564   -0.7439    0.0363 H   0  0  0  0  0
    7.3781    5.3127    0.8662 H   0  0  0  0  0
    6.1981    4.8982   -0.3700 H   0  0  0  0  0
    7.9028    4.0221   -2.6702 H   0  0  0  0  0
    9.1686    5.2742   -4.3748 H   0  0  0  0  0
   10.0102    7.5560   -3.8810 H   0  0  0  0  0
    9.5719    8.5850   -1.6678 H   0  0  0  0  0
    8.3209    7.3429    0.0575 H   0  0  0  0  0
  1  2  1  0  0  0
  1 23  1  0  0  0
  1 24  1  0  0  0
  1 25  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  4  5  1  0  0  0
  4 26  1  0  0  0
  5  6  1  0  0  0
  5 27  1  0  0  0
  5 28  1  0  0  0
  6  7  1  0  0  0
  6 29  1  0  0  0
  6 30  1  0  0  0
  7 15  1  0  0  0
  7  8  2  0  0  0
  8  9  1  0  0  0
  8 16  1  0  0  0
  9 10  1  0  0  0
  9 31  1  0  0  0
 10 15  1  0  0  0
 10 11  2  0  0  0
 11 12  1  0  0  0
 11 32  1  0  0  0
 12 13  2  0  0  0
 12 33  1  0  0  0
 13 14  1  0  0  0
 13 34  1  0  0  0
 14 15  2  0  0  0
 14 35  1  0  0  0
 16 17  1  0  0  0
 16 36  1  0  0  0
 16 37  1  0  0  0
 17 18  2  0  0  0
 17 22  1  0  0  0
 18 19  1  0  0  0
 18 38  1  0  0  0
 19 20  2  0  0  0
 19 39  1  0  0  0
 20 21  1  0  0  0
 20 40  1  0  0  0
 21 22  2  0  0  0
 21 41  1  0  0  0
 22 42  1  0  0  0
M  END

>  <Chemical Name>
luzindole

>  <PubChem CID>
122162

>  <Formula>
C19H20N2O

>  <Molecular Weight>
292.382000

>  <IUPAC Name>
N-[2-(2-benzyl-1H-indol-3-yl)ethyl]acetamide

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
CC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3

>  <Isomeric SMILES>
CC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3

>  <InChI Std. ID>
InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)

>  <InChI Key>
WVVXBPKOIZGVNS-UHFFFAOYSA-N

