60107092
  -OEChem-04232415022D

 32 34  0     0  0  0  0  0  0999 V2000
   10.6350   -1.5210    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.0591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0531   -1.4404    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.5591    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.5591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4103    0.2544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4103    1.8638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9939    1.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7210   -0.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    1.5591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6995   -0.9024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3673   -0.1581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0102   -1.8529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3458   -0.3643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9887   -2.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6565   -1.3148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.5591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6029    2.4532    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6139    1.0591    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.5609    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.6791    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1951    0.2491    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1747    0.4313    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5961   -2.3144    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7599    0.0972    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1813   -2.6484    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    2.0960    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    1.2491    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    1.0222    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 19  1  0  0  0  0
  2 12  1  0  0  0  0
  2 20  1  0  0  0  0
  3 11  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  5  7  2  0  0  0  0
  5 10  1  0  0  0  0
  6  8  2  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
  7 21  1  0  0  0  0
  8 22  1  0  0  0  0
  9 13  2  0  0  0  0
  9 23  1  0  0  0  0
 10 12  2  0  0  0  0
 10 24  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 13 25  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 26  1  0  0  0  0
 16 18  2  0  0  0  0
 16 27  1  0  0  0  0
 17 19  2  0  0  0  0
 17 28  1  0  0  0  0
 18 19  1  0  0  0  0
 18 29  1  0  0  0  0
 20 30  1  0  0  0  0
 20 31  1  0  0  0  0
 20 32  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
60107092

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
354

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccB6MQAAAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAFgB8AAAHwAAAAAADAzBng4+xrMMHACoA7R3RACCiCA3IiAI2CG+bNgMJvLEtbuEMShmwBnI6YeYyeCeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(4-fluorophenyl)-(7-methoxyindolizin-3-yl)methanone

> <PUBCHEM_IUPAC_CAS_NAME>
(4-fluorophenyl)-(7-methoxy-3-indolizinyl)methanone

> <PUBCHEM_IUPAC_NAME_MARKUP>
(4-fluorophenyl)-(7-methoxyindolizin-3-yl)methanone

> <PUBCHEM_IUPAC_NAME>
(4-fluorophenyl)-(7-methoxyindolizin-3-yl)methanone

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(4-fluorophenyl)-(7-methoxyindolizin-3-yl)methanone

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(4-fluorophenyl)-(7-methoxyindolizin-3-yl)methanone

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C16H12FNO2/c1-20-14-8-9-18-13(10-14)6-7-15(18)16(19)11-2-4-12(17)5-3-11/h2-10H,1H3

> <PUBCHEM_IUPAC_INCHIKEY>
SQJIIJZMUPENJL-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
4.2

> <PUBCHEM_EXACT_MASS>
269.08520679

> <PUBCHEM_MOLECULAR_FORMULA>
C16H12FNO2

> <PUBCHEM_MOLECULAR_WEIGHT>
269.27

> <PUBCHEM_OPENEYE_CAN_SMILES>
COC1=CC2=CC=C(N2C=C1)C(=O)C3=CC=C(C=C3)F

> <PUBCHEM_OPENEYE_ISO_SMILES>
COC1=CC2=CC=C(N2C=C1)C(=O)C3=CC=C(C=C3)F

> <PUBCHEM_CACTVS_TPSA>
30.7

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
269.08520679

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
20

> <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  12  8
12  13  8
14  15  8
14  16  8
15  17  8
16  18  8
17  19  8
18  19  8
4  5  8
4  6  8
4  9  8
5  10  8
5  7  8
6  8  8
7  8  8
9  13  8

$$$$