11378442
  -OEChem-04232407042D

  4  2  0     0  0  0  0  0  0999 V2000
    2.0000   -0.0000    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.5000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.5981    0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  4  3  0  0  0  0
M  CHG  2   1   1   2  -1
M  END
> <PUBCHEM_COMPOUND_CID>
11378442

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
34.5

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQACIAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABgAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
potassium;cyanate

> <PUBCHEM_IUPAC_CAS_NAME>
potassium;cyanate

> <PUBCHEM_IUPAC_NAME_MARKUP>
potassium;cyanate

> <PUBCHEM_IUPAC_NAME>
potassium;cyanate

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
potassium;cyanate

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
potassium;cyanate

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/CHNO.K/c2-1-3;/h3H;/q;+1/p-1

> <PUBCHEM_IUPAC_INCHIKEY>
GKKCIDNWFBPDBW-UHFFFAOYSA-M

> <PUBCHEM_EXACT_MASS>
80.96169511

> <PUBCHEM_MOLECULAR_FORMULA>
CKNO

> <PUBCHEM_MOLECULAR_WEIGHT>
81.115

> <PUBCHEM_OPENEYE_CAN_SMILES>
C(#N)[O-].[K+]

> <PUBCHEM_OPENEYE_ISO_SMILES>
C(#N)[O-].[K+]

> <PUBCHEM_CACTVS_TPSA>
46.8

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
80.96169511

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
4

> <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_NONSTANDARDBOND>
1  2  7

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$