Marvin  06180915272D          

 27 29  0  0  0  0            999 V2000
   -2.1988    0.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9133    0.7367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6278    0.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6278   -0.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9134   -0.9133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1988   -0.5008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4844   -0.9133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7699   -0.5008    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4844   -1.7384    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4843    0.7366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0554   -0.9134    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6591   -0.5009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3736   -0.9134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6591    0.3241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3735   -1.7384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6590   -2.1509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0880   -2.1509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0555   -1.7385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7700   -2.1510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7700   -2.9759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0555   -3.3884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6589   -2.9759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5169   -2.1510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8025   -1.7384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0879   -2.9760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8024   -3.3884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5169   -2.9759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  1 10  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 16 22  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 24 17  2  0  0  0  0
 17 25  1  0  0  0  0
 23 24  1  0  0  0  0
 23 27  2  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
M  END
> <ID>
CHEBI:52607

> <NAME>
N'-(3,3-diphenylpropanoyl)-2-hydroxybenzohydrazide

> <STAR>
3

> <SYNONYM>
N-3,3-diphenylpropionylsalicylhydrazine; N-3,3-diphenylpropionylsalicylhydrazide; N-3,3-diphenylpropionylsalicylhydrazidate; H3dppshz

> <IUPAC_NAME>
N'-(3,3-diphenylpropanoyl)-2-hydroxybenzohydrazide

> <FORMULA>
C22H20N2O3

> <MASS>
360.40580

> <MONOISOTOPIC_MASS>
360.14739

> <CHARGE>
0

> <SMILES>
Oc1ccccc1C(=O)NNC(=O)CC(c1ccccc1)c1ccccc1

> <INCHI>
InChI=1S/C22H20N2O3/c25-20-14-8-7-13-18(20)22(27)24-23-21(26)15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14,19,25H,15H2,(H,23,26)(H,24,27)

> <INCHIKEY>
YRIHNTLWSRTOIF-UHFFFAOYSA-N

$$$$