23516918
  -OEChem-04262404002D

 27 29  0     1  0  0  0  0  0999 V2000
    2.0000    0.7508    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.2648    0.1170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3707   -1.6618    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0047    1.3771    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5047   -0.1618    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.3707   -0.6618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6957    0.4260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3137    0.4260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6387   -0.6618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0047    1.3771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5047   -2.1618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6387   -1.6618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6803    0.1937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3197    2.1618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9773    0.9624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2992    1.9531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9813   -0.7695    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5828   -0.0792    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1017   -0.3518    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9077   -1.9718    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3691    1.8786    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1062   -2.6367    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9032   -2.6367    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1017   -1.9718    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4955   -0.3981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5181    2.7492    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8861    2.4154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  2  8  2  0  0  0  0
  3  6  1  0  0  0  0
  3 11  1  0  0  0  0
  3 20  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  1  0  0  0  0
  4 21  1  0  0  0  0
  5  6  1  1  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
  7 10  2  0  0  0  0
  7 13  1  0  0  0  0
  9 12  2  0  0  0  0
  9 19  1  0  0  0  0
 10 14  1  0  0  0  0
 11 12  1  0  0  0  0
 11 22  1  0  0  0  0
 11 23  1  0  0  0  0
 12 24  1  0  0  0  0
 13 15  2  0  0  0  0
 13 25  1  0  0  0  0
 14 16  2  0  0  0  0
 14 26  1  0  0  0  0
 15 16  1  0  0  0  0
 16 27  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
23516918

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
344

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
2

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzIAAEAAAAAAAAAAAAAAAAAWAAAAAwQAAAAAAAAFgBAAAAHgIQAAAADgrBmCQwwILAAACIAiVSUACCAAAhBwAIiIEIZogIIDrB15GEIAhglADIyAcciMCPgABAIAACAAAAAIBAAAQAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(3R)-5'-chlorospiro[2,6-dihydro-1H-pyridine-3,3'-indoline]-2'-one

> <PUBCHEM_IUPAC_CAS_NAME>
(3R)-5-chloro-2-spiro[1H-indole-3,3'-2,6-dihydro-1H-pyridine]one

> <PUBCHEM_IUPAC_NAME_MARKUP>
(3<I>R</I>)-5-chlorospiro[1<I>H</I>-indole-3,3&apos;-2,6-dihydro-1<I>H</I>-pyridine]-2-one

> <PUBCHEM_IUPAC_NAME>
(3R)-5-chlorospiro[1H-indole-3,3'-2,6-dihydro-1H-pyridine]-2-one

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(3R)-5-chloranylspiro[1H-indole-3,3'-2,6-dihydro-1H-pyridine]-2-one

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(3R)-5'-chlorospiro[2,6-dihydro-1H-pyridine-3,3'-indoline]-2'-one

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C12H11ClN2O/c13-8-2-3-10-9(6-8)12(11(16)15-10)4-1-5-14-7-12/h1-4,6,14H,5,7H2,(H,15,16)/t12-/m0/s1

> <PUBCHEM_IUPAC_INCHIKEY>
QEUGNJMJQWOZQJ-LBPRGKRZSA-N

> <PUBCHEM_XLOGP3_AA>
1.2

> <PUBCHEM_EXACT_MASS>
234.0559907

> <PUBCHEM_MOLECULAR_FORMULA>
C12H11ClN2O

> <PUBCHEM_MOLECULAR_WEIGHT>
234.68

> <PUBCHEM_OPENEYE_CAN_SMILES>
C1C=CC2(CN1)C3=C(C=CC(=C3)Cl)NC2=O

> <PUBCHEM_OPENEYE_ISO_SMILES>
C1C=C[C@]2(CN1)C3=C(C=CC(=C3)Cl)NC2=O

> <PUBCHEM_CACTVS_TPSA>
41.1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
234.0559907

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
16

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
1

> <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
13  15  8
14  16  8
15  16  8
5  6  5
7  10  8
7  13  8

$$$$