6432248
  -OEChem-04262421212D

 15 13  0     0  0  0  0  0  0999 V2000
    0.5369    1.5000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.4030    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.2690    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    4.4750    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4030    1.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4030    3.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5369    4.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0044    3.5000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8015    3.5000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8059    4.7850    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5790    3.9380    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9590    5.0119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8469    5.0119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.7850    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2269    3.9380    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  4 12  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
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
M  CHG  4   1  -1   2  -1   4   1   5   1
M  END
> <PUBCHEM_COMPOUND_CID>
6432248

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
21.5

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBDMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHAAUAAAAAADBAAQCAABAQAABAAAAAQAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
ethylammonium;nitrate

> <PUBCHEM_IUPAC_CAS_NAME>
ethylammonium;nitrate

> <PUBCHEM_IUPAC_NAME_MARKUP>
ethylazanium;nitrate

> <PUBCHEM_IUPAC_NAME>
ethylazanium;nitrate

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
ethylazanium;nitrate

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
ethylammonium;nitrate

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C2H7N.NO3/c1-2-3;2-1(3)4/h2-3H2,1H3;/q;-1/p+1

> <PUBCHEM_IUPAC_INCHIKEY>
AHRQMWOXLCFNAV-UHFFFAOYSA-O

> <PUBCHEM_EXACT_MASS>
108.05349212

> <PUBCHEM_MOLECULAR_FORMULA>
C2H8N2O3

> <PUBCHEM_MOLECULAR_WEIGHT>
108.10

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC[NH3+].[N+](=O)([O-])[O-]

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC[NH3+].[N+](=O)([O-])[O-]

> <PUBCHEM_CACTVS_TPSA>
90.5

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
108.05349212

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
7

> <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

$$$$