SMIRKS
O=[C:4]([C:3]([C:2]([C:1]([H:14])([H:15])[H:16])([H:12])[H:13])([H:10])[H:11])[H:9].[H][N:6]([H:17])[H:18].[H][O:7][O:8][H]>>[H][C:4]([C:3]([C:2]([C:1]([H:14])([H:15])[H:16])([H:12])[H:13])([H:10])[H:11])([N:6]([H:17])[H:18])[H:9].[O:7]=[O:8]
Derived Operators
EVODEX.1-F33 - Elemental Balance
| O | -1 |
| H | -2 |
EVODEX.1-M4 - Mass Difference
-18.010559999999998
EVODEX.1-E492 - Reaction Operator E
[#6:18]-[#6:19](=[#8])-[H:31].[#7:23](-[H:42])(-[H:43])-[H].[#8:24](-[#8:25]-[H])-[H]>>[#6:18]-[#6:19](-[#7:23](-[H:42])-[H:43])(-[H:31])-[H].[#8:24]=[#8:25]
EVODEX.1-C105 - Reaction Operator C
[#8]=[#6:19].[H]-[#7:23].[H]-[#8:24]-[#8:25]-[H]>>[H]-[#6:19]-[#7:23].[#8:24]=[#8:25]
EVODEX.1-N244 - Reaction Operator N
[#8]=[#6:19](-[#6:18])-[H:33].[H]-[#7:23](-[H:42])-[H:43].[H]-[#8:24]-[#8:25]-[H]>>[H]-[#6:19](-[#6:18])(-[#7:23](-[H:42])-[H:43])-[H:33].[#8:24]=[#8:25]
EVODEX.1-Em366 - Reaction Operator Em
[#8]=[#6:19]-[#6:18].[H]-[#7:23].[H]-[#8:24]-[#8:25]-[H]>>[H]-[#6:19](-[#6:18])-[#7:23].[#8:24]=[#8:25]
EVODEX.1-Cm130 - Reaction Operator Cm
[#8]=[#6:19].[H]-[#7:23].[H]-[#8:24]-[#8:25]-[H]>>[H]-[#6:19]-[#7:23].[#8:24]=[#8:25]
EVODEX.1-Nm326 - Reaction Operator Nm
[#8]=[#6:19]-[#6:18].[H]-[#7:23].[H]-[#8:24]-[#8:25]-[H]>>[H]-[#6:19](-[#6:18])-[#7:23].[#8:24]=[#8:25]
Source Full Reactions
EVODEX.1-R996
[C:1]([C:2]([C:3]([C:4](=[O:5])[H:9])([H:10])[H:11])([H:12])[H:13])([H:14])([H:15])[H:16].[H][N:6]([H:17])[H:18].[H][O:7][O:8][H]>>[H][C:4]([C:3]([C:2]([C:1]([H:14])([H:15])[H:16])([H:12])[H:13])([H:10])[H:11])([N:6]([H:17])[H:18])[H:9].[O:7]=[O:8].[H][O:5][H]