SMIRKS
[H]N([H])[C:4]([H])([C:2]([C:1]([H:15])([H:16])[H:17])([O:3][H:9])[H:14])[H:12].[H][O:6][H]>>[C:1]([C:2]([O:3][H:9])([C:4](=[O:6])[H:12])[H:14])([H:15])([H:16])[H:17]
Derived Operators
EVODEX.1-F71 - Elemental Balance
N | -1 |
H | -5 |
EVODEX.1-M59 - Mass Difference
-19.04225
EVODEX.1-E618 - Reaction Operator E
[#6:2]-[#6:4](-[#7](-[H])-[H])(-[H:12])-[H].[#8:6](-[H])-[H]>>[#6:2]-[#6:4](=[#8:6])-[H:12]
EVODEX.1-N235 - Reaction Operator N
[H]-[#7](-[H])-[#6:4](-[H])(-[#6:2])-[H:12].[H]-[#8:6]-[H]>>[#6:2]-[#6:4](=[#8:6])-[H:12]
EVODEX.1-Em350 - Reaction Operator Em
[H]-[#7](-[H])-[#6:4](-[H])-[#6:2].[H]-[#8:6]-[H]>>[#6:2]-[#6:4]=[#8:6]
EVODEX.1-Nm317 - Reaction Operator Nm
[H]-[#7](-[H])-[#6:4](-[H])-[#6:2].[H]-[#8:6]-[H]>>[#6:2]-[#6:4]=[#8:6]
Source Full Reactions
EVODEX.1-R1039
[H][C:4]([C:2]([C:1]([H:15])([H:16])[H:17])([O:3][H:9])[H:14])([N:5]([H:10])[H:11])[H:12].[O:7]=[O:8].[H][O:6][H]>>[C:1]([C:2]([O:3][H:9])([C:4](=[O:6])[H:12])[H:14])([H:15])([H:16])[H:17].[H][N:5]([H:10])[H:11].[H][O:7][O:8][H]