SMIRKS
[H][C:2]1([N:1]([H:22])[H:23])[C:3]([H:12])([H:13])[C:4]([H:14])([H:15])[C:5]([H:16])([H:17])[C:6]([H:18])([H:19])[C:7]1([H:20])[H:21].[O:9]=[O:10]>>O=[C:2]1[C:3]([H:12])([H:13])[C:4]([H:14])([H:15])[C:5]([H:16])([H:17])[C:6]([H:18])([H:19])[C:7]1([H:20])[H:21].[H][N:1]([H:22])[H:23].[H][O:9][O:10][H]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E385 - Reaction Operator E
[#7:1](-[#6:2](-[#6:3])(-[#6:9])-[H])(-[H:29])-[H:30].[#8:16]=[#8:17]>>[#6:2](-[#6:3])(-[#6:9])=[#8].[#7:1](-[H:29])(-[H:30])-[H].[#8:16](-[#8:17]-[H])-[H]
EVODEX.1-C28 - Reaction Operator C
[H]-[#6:1]-[#7:2].[#8:13]=[#8:14]>>[#8]=[#6:1].[H]-[#7:2].[H]-[#8:13]-[#8:14]-[H]
EVODEX.1-N43 - Reaction Operator N
[H]-[#6@:2](-[#6:1])(-[#7:3](-[H:17])-[H:18])-[#6:4].[#8:15]=[#8:16]>>[#8]=[#6:2](-[#6:1])-[#6:4].[H]-[#7:3](-[H:17])-[H:18].[H]-[#8:15]-[#8:16]-[H]
EVODEX.1-Em355 - Reaction Operator Em
[H]-[#6:2](-[#6:1])(-[#7:3])-[#6:4].[#8:15]=[#8:16]>>[#8]=[#6:2](-[#6:1])-[#6:4].[H]-[#7:3].[H]-[#8:15]-[#8:16]-[H]
EVODEX.1-Cm67 - Reaction Operator Cm
[H]-[#6:1]-[#7:2].[#8:13]=[#8:14]>>[#8]=[#6:1].[H]-[#7:2].[H]-[#8:13]-[#8:14]-[H]
EVODEX.1-Nm116 - Reaction Operator Nm
[H]-[#6:2](-[#6:1])(-[#7:3])-[#6:4].[#8:15]=[#8:16]>>[#8]=[#6:2](-[#6:1])-[#6:4].[H]-[#7:3].[H]-[#8:15]-[#8:16]-[H]
Source Full Reactions
EVODEX.1-R925
[H][C:2]1([N:1]([H:22])[H:23])[C:3]([H:12])([H:13])[C:4]([H:14])([H:15])[C:5]([H:16])([H:17])[C:6]([H:18])([H:19])[C:7]1([H:20])[H:21].[O:9]=[O:10].[H][O:8][H]>>[C:2]1(=[O:8])[C:3]([H:12])([H:13])[C:4]([H:14])([H:15])[C:5]([H:16])([H:17])[C:6]([H:18])([H:19])[C:7]1([H:20])[H:21].[H][N:1]([H:22])[H:23].[H][O:9][O:10][H]