59990162
  -OEChem-05112411472D

 52 55  0     0  0  0  0  0  0999 V2000
    8.9962    1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3981   -0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2641    0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.8622   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8622   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7561   -1.7847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8000    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8000    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6660   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1301   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9962   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622   -1.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1301   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5321    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9962    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7561    0.2847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9061    1.7847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6622   -0.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6660    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5321    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9061   -0.2847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7446   -2.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6660   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2641   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5263   -1.7742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9176    2.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9962   -2.3700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7490    0.9046    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1979    0.0829    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6660    2.3700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0690    1.5600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9132   -0.9046    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1246   -2.7774    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7374   -3.4046    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3645   -2.7918    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3981   -0.8700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0460   -1.2500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6660   -1.8700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2860   -1.2500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4643    1.5829    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9541   -1.2131    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7272   -2.0600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5741   -2.2869    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2142   -2.3099    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0620   -2.0862    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8384   -1.2384    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4643   -0.0829    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5376    2.7774    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9248    3.4046    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2977    2.7918    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  2  0  0  0  0
  2  3  1  0  0  0  0
  2 14  1  0  0  0  0
  2 38  1  0  0  0  0
  3 13  2  3  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4 11  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 12  2  0  0  0  0
  6 22  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 21  2  0  0  0  0
  8 17  2  0  0  0  0
  8 19  1  0  0  0  0
  9 14  2  0  0  0  0
  9 23  1  0  0  0  0
 10 11  2  0  0  0  0
 10 13  1  0  0  0  0
 10 25  1  0  0  0  0
 11 29  1  0  0  0  0
 12 18  1  0  0  0  0
 12 26  1  0  0  0  0
 13 15  1  0  0  0  0
 14 20  1  0  0  0  0
 16 18  2  0  0  0  0
 16 30  1  0  0  0  0
 17 24  1  0  0  0  0
 17 28  1  0  0  0  0
 18 31  1  0  0  0  0
 19 20  2  0  0  0  0
 19 32  1  0  0  0  0
 20 33  1  0  0  0  0
 21 27  1  0  0  0  0
 21 34  1  0  0  0  0
 22 35  1  0  0  0  0
 22 36  1  0  0  0  0
 22 37  1  0  0  0  0
 23 39  1  0  0  0  0
 23 40  1  0  0  0  0
 23 41  1  0  0  0  0
 24 27  2  0  0  0  0
 24 42  1  0  0  0  0
 25 43  1  0  0  0  0
 25 44  1  0  0  0  0
 25 45  1  0  0  0  0
 26 46  1  0  0  0  0
 26 47  1  0  0  0  0
 26 48  1  0  0  0  0
 27 49  1  0  0  0  0
 28 50  1  0  0  0  0
 28 51  1  0  0  0  0
 28 52  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
59990162

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
666

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
2

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceB7IAAAAAAAAAAAAAAAAAAAAAAAAAAwYMEAAAAAAADBVAAAHgAYAAAADAyBmAAywMBiAACoA6RyQACSBAAkAgAYiAEgZNgIIDKAlZGAIQBgmAAIyYcYiMCOyAACQAASAACQAASAACQAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
2-[(1,5-dimethyl-2-naphthyl)hydrazono]-3,5,6-trimethyl-naphthalen-1-one

> <PUBCHEM_IUPAC_CAS_NAME>
2-[(1,5-dimethyl-2-naphthalenyl)hydrazinylidene]-3,5,6-trimethyl-1-naphthalenone

> <PUBCHEM_IUPAC_NAME_MARKUP>
2-[(1,5-dimethylnaphthalen-2-yl)hydrazinylidene]-3,5,6-trimethylnaphthalen-1-one

> <PUBCHEM_IUPAC_NAME>
2-[(1,5-dimethylnaphthalen-2-yl)hydrazinylidene]-3,5,6-trimethylnaphthalen-1-one

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
2-[(1,5-dimethylnaphthalen-2-yl)hydrazinylidene]-3,5,6-trimethyl-naphthalen-1-one

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
2-[(1,5-dimethyl-2-naphthyl)hydrazono]-3,5,6-trimethyl-naphthalen-1-one

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C25H24N2O/c1-14-9-10-21-22(17(14)4)13-16(3)24(25(21)28)27-26-23-12-11-19-15(2)7-6-8-20(19)18(23)5/h6-13,26H,1-5H3

> <PUBCHEM_IUPAC_INCHIKEY>
KLSNEYYQRFBQSN-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
6.7

> <PUBCHEM_EXACT_MASS>
368.188863393

> <PUBCHEM_MOLECULAR_FORMULA>
C25H24N2O

> <PUBCHEM_MOLECULAR_WEIGHT>
368.5

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=C2C=CC(=C(C2=CC=C1)C)NN=C3C(=CC4=C(C3=O)C=CC(=C4C)C)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1=C2C=CC(=C(C2=CC=C1)C)NN=C3C(=CC4=C(C3=O)C=CC(=C4C)C)C

> <PUBCHEM_CACTVS_TPSA>
41.5

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
368.188863393

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
28

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
1

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
12  18  8
14  20  8
16  18  8
17  24  8
19  20  8
21  27  8
24  27  8
3  13  1
4  5  8
4  6  8
5  16  8
6  12  8
7  21  8
7  8  8
7  9  8
8  17  8
8  19  8
9  14  8

$$$$