SMIRKS
[H][C@:2]1([N:1]([H:26])[H:27])[C:3]([H:16])([H:17])[C:4]([H:18])([H:19])[C:5]([H:20])([H:21])[C:6]2:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:21.[O:13]=[O:14].[H][O:12][H]>>[C:2]1(=[O:12])[C:3]([H:16])([H:17])[C:4]([H:18])([H:19])[C:5]([H:20])([H:21])[C:6]2:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:21.[H][N:1]([H:26])[H:27].[H][O:13][O:14][H]
Derived Operators
EVODEX.1-E218 - Reaction Operator E
[#7:1](-[#6:2](-[#6:3])(-[#6:9])-[H])(-[H:29])-[H:30].[#8:16]=[#8:17].[#8:15](-[H])-[H]>>[#6:2](-[#6:3])(-[#6:9])=[#8:15].[#7:1](-[H:29])(-[H:30])-[H].[#8:16](-[#8:17]-[H])-[H]
EVODEX.1-C29 - Reaction Operator C
[H]-[#6:1]-[#7:2].[#8:13]=[#8:14].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2].[H]-[#8:13]-[#8:14]-[H]
EVODEX.1-N45 - Reaction Operator N
[H]-[#6:2](-[#7:1](-[H:29])-[H:30])(-[#6:3])-[#6:9].[#8:17]=[#8:18].[H]-[#8:16]-[H]>>[#6:2](-[#6:3])(-[#6:9])=[#8:16].[H]-[#7:1](-[H:29])-[H:30].[H]-[#8:17]-[#8:18]-[H]
EVODEX.1-Em359 - Reaction Operator Em
[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:9].[#8:17]=[#8:18].[H]-[#8:16]-[H]>>[#6:2](-[#6:3])(-[#6:9])=[#8:16].[H]-[#7:1].[H]-[#8:17]-[#8:18]-[H]
EVODEX.1-Cm68 - Reaction Operator Cm
[H]-[#6:1]-[#7:2].[#8:13]=[#8:14].[H]-[#8:12]-[H]>>[#6:1]=[#8:12].[H]-[#7:2].[H]-[#8:13]-[#8:14]-[H]
EVODEX.1-Nm118 - Reaction Operator Nm
[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:9].[#8:17]=[#8:18].[H]-[#8:16]-[H]>>[#6:2](-[#6:3])(-[#6:9])=[#8:16].[H]-[#7:1].[H]-[#8:17]-[#8:18]-[H]
Source Full Reactions
EVODEX.1-R931
[H][C@:2]1([N:1]([H:26])[H:27])[C:3]([H:16])([H:17])[C:4]([H:18])([H:19])[C:5]([H:20])([H:21])[C:6]2:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:21.[O:13]=[O:14].[H][O:12][H]>>[C:2]1(=[O:12])[C:3]([H:16])([H:17])[C:4]([H:18])([H:19])[C:5]([H:20])([H:21])[C:6]2:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:21.[H][N:1]([H:26])[H:27].[H][O:13][O:14][H]