23500708
  -OEChem-04192420112D

 29 30  0     1  0  0  0  0  0999 V2000
    0.0000    3.3875    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1324    7.4090    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.2648    2.7537    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3707    0.9749    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0047    4.0138    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5047    2.4750    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.3707    1.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6957    3.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3137    3.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6387    1.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0047    4.0138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5047    0.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6387    0.9749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6803    2.8305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3197    4.7985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9773    3.5992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2992    4.5898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9813    1.8673    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5828    2.5576    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1017    2.2849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9077    0.6649    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3691    4.5154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1062    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9032    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1017    0.6649    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4955    2.2386    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5181    5.3859    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8861    5.0522    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1324    7.4090    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 16  1  0  0  0  0
  2 29  1  0  0  0  0
  3  9  2  0  0  0  0
  4  7  1  0  0  0  0
  4 12  1  0  0  0  0
  4 21  1  0  0  0  0
  5  9  1  0  0  0  0
  5 11  1  0  0  0  0
  5 22  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8 11  2  0  0  0  0
  8 14  1  0  0  0  0
 10 13  2  0  0  0  0
 10 20  1  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  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 17  2  0  0  0  0
 15 27  1  0  0  0  0
 16 17  1  0  0  0  0
 17 28  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
23500708

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
344

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
3

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzIAAGAAAAAAAAAAAAAAAAAWAAAAAwQAAAAAAAAFgBAAAAHgIQAAAADgrBmCQwwILAAACIAiVSUACCAAAhBwAIiIEIZogIIDrB15GEIAhglADIyAcciMCPgABAIAACAAAAAIBAAAQAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
5'-chlorospiro[2,6-dihydro-1H-pyridine-3,3'-indoline]-2'-one;hydrochloride

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

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

> <PUBCHEM_IUPAC_NAME>
5-chlorospiro[1H-indole-3,3'-2,6-dihydro-1H-pyridine]-2-one;hydrochloride

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
5-chloranylspiro[1H-indole-3,3'-2,6-dihydro-1H-pyridine]-2-one;hydrochloride

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
5'-chlorospiro[2,6-dihydro-1H-pyridine-3,3'-indoline]-2'-one;hydrochloride

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C12H11ClN2O.ClH/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);1H

> <PUBCHEM_IUPAC_INCHIKEY>
MHZDOBMXKNQXPF-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
270.0326684

> <PUBCHEM_MOLECULAR_FORMULA>
C12H12Cl2N2O

> <PUBCHEM_MOLECULAR_WEIGHT>
271.14

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

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

> <PUBCHEM_CACTVS_TPSA>
41.1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
270.0326684

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
17

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
1

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
2

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
11  15  8
14  16  8
15  17  8
16  17  8
6  7  3
8  11  8
8  14  8

$$$$