5897
  -OEChem-05122408252D

 30 32  0     0  0  0  0  0  0999 V2000
    8.3987   -1.3027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0321    0.3901    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5274    1.3027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3364    0.7149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0274   -0.2362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7183    0.7149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0274   -0.2362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3518    0.9471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7123   -1.0209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7029    0.9471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3424   -1.0209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0547    0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7328   -0.8122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3219   -0.8122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7040   -0.3504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6814   -0.1388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9422    1.7634    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1125    1.7634    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5365    1.5390    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5139   -1.6083    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5182    1.5390    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5408   -1.6083    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1459   -1.2746    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3940    0.3097    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9088   -1.2746    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2214    0.9805    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8126   -0.7447    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2873   -0.0075    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5502    0.4672    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 16  2  0  0  0  0
  2 12  1  0  0  0  0
  2 16  1  0  0  0  0
  2 27  1  0  0  0  0
  3  4  1  0  0  0  0
  3  6  1  0  0  0  0
  3 18  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  2  0  0  0  0
  8 12  2  0  0  0  0
  8 20  1  0  0  0  0
  9 13  2  0  0  0  0
  9 21  1  0  0  0  0
 10 14  1  0  0  0  0
 10 22  1  0  0  0  0
 11 15  1  0  0  0  0
 11 23  1  0  0  0  0
 12 13  1  0  0  0  0
 13 24  1  0  0  0  0
 14 15  2  0  0  0  0
 14 25  1  0  0  0  0
 15 26  1  0  0  0  0
 16 17  1  0  0  0  0
 17 28  1  0  0  0  0
 17 29  1  0  0  0  0
 17 30  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
5897

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
301

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccByIAAAAAAAAAAAAAAAAAAAAYAAAAAwYAAAAAAAAGABQAAAHgAQAAAADAiBmAAywILAAACIAiVSUACCAAAhAgAIiAAAZIgIICLAkZGEIAhglADIyAcQgMAOiAAAQAAQAAAQAACAACAAAQAACAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
N-(9H-fluoren-2-yl)acetamide

> <PUBCHEM_IUPAC_CAS_NAME>
N-(9H-fluoren-2-yl)acetamide

> <PUBCHEM_IUPAC_NAME_MARKUP>
<I>N</I>-(9<I>H</I>-fluoren-2-yl)acetamide

> <PUBCHEM_IUPAC_NAME>
N-(9H-fluoren-2-yl)acetamide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
N-(9H-fluoren-2-yl)ethanamide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
N-(9H-fluoren-2-yl)acetamide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C15H13NO/c1-10(17)16-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9H,8H2,1H3,(H,16,17)

> <PUBCHEM_IUPAC_INCHIKEY>
CZIHNRWJTSTCEX-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3>
3.3

> <PUBCHEM_EXACT_MASS>
223.099714038

> <PUBCHEM_MOLECULAR_FORMULA>
C15H13NO

> <PUBCHEM_MOLECULAR_WEIGHT>
223.27

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2

> <PUBCHEM_CACTVS_TPSA>
29.1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
223.099714038

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
17

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
10  14  8
11  15  8
12  13  8
14  15  8
4  5  8
4  8  8
5  9  8
6  10  8
6  7  8
7  11  8
8  12  8
9  13  8

$$$$