24747132
  -OEChem-05062422212D

 32 33  0     0  0  0  0  0  0999 V2000
    3.9874    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.6648    5.8491    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6648    4.1170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    4.6170    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0812    3.3123    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    3.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6648    4.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0812    4.9218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6648    4.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    5.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    4.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    3.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    3.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1648    4.9831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1648    3.2510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5369    5.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1648    4.9831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1648    3.2510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6648    4.1170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2738    5.5111    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    5.7370    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    2.4970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    3.3070    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8548    5.5200    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8548    2.7141    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8469    5.6540    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.4270    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2269    4.5801    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4748    2.7141    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3548    6.3860    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9748    3.5801    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9874    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 32  1  0  0  0  0
  2 17  1  0  0  0  0
  2 30  1  0  0  0  0
  3 19  1  0  0  0  0
  3 31  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6 12  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 20  1  0  0  0  0
  9 14  2  0  0  0  0
  9 15  1  0  0  0  0
 10 11  2  0  0  0  0
 10 21  1  0  0  0  0
 11 13  1  0  0  0  0
 11 16  1  0  0  0  0
 12 13  2  0  0  0  0
 12 22  1  0  0  0  0
 13 23  1  0  0  0  0
 14 17  1  0  0  0  0
 14 24  1  0  0  0  0
 15 18  2  0  0  0  0
 15 25  1  0  0  0  0
 16 26  1  0  0  0  0
 16 27  1  0  0  0  0
 16 28  1  0  0  0  0
 17 19  2  0  0  0  0
 18 19  1  0  0  0  0
 18 29  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
24747132

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
300

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
3

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzMAAEAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAFgB8AAAHgAACAAADAzBnwQ/tp8MGgCgAzZnZACCgC0xMqAJ2CA+/JiJbuLCmZOUcAlswBPJ2Cew0LMOIAABAAAAQABAAAIAAACAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
4-(6-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

> <PUBCHEM_IUPAC_CAS_NAME>
4-(6-methyl-2-imidazo[1,2-a]pyridinyl)benzene-1,2-diol;hydrochloride

> <PUBCHEM_IUPAC_NAME_MARKUP>
4-(6-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

> <PUBCHEM_IUPAC_NAME>
4-(6-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
4-(6-methylimidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol;hydrochloride

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
4-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrocatechol;hydrochloride

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C14H12N2O2.ClH/c1-9-2-5-14-15-11(8-16(14)7-9)10-3-4-12(17)13(18)6-10;/h2-8,17-18H,1H3;1H

> <PUBCHEM_IUPAC_INCHIKEY>
YWAYDKKWJDMLAH-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
276.0665554

> <PUBCHEM_MOLECULAR_FORMULA>
C14H13ClN2O2

> <PUBCHEM_MOLECULAR_WEIGHT>
276.72

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CN2C=C(N=C2C=C1)C3=CC(=C(C=C3)O)O.Cl

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1=CN2C=C(N=C2C=C1)C3=CC(=C(C=C3)O)O.Cl

> <PUBCHEM_CACTVS_TPSA>
57.8

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
276.0665554

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
19

> <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>
2

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
10  11  8
11  13  8
12  13  8
14  17  8
15  18  8
17  19  8
18  19  8
4  10  8
4  6  8
4  8  8
5  6  8
5  7  8
6  12  8
7  8  8
9  14  8
9  15  8

$$$$