SMIRKS
[H][C@@:6]([C:5]1:[C:4]([H:15]):[C:3]([H:14]):[C:2]([C:1]([H:24])([H:25])[H:26]):[C:10]([H:23]):[C:9]:1[H:22])([C:7]([H:16])([H:17])[H:18])[N:8]([H:19])[H:20].[O:12]=[O:13]>>O=[C:6]([C:5]1:[C:4]([H:15]):[C:3]([H:14]):[C:2]([C:1]([H:24])([H:25])[H:26]):[C:10]([H:23]):[C:9]:1[H:22])[C:7]([H:16])([H:17])[H:18].[H][N:8]([H:19])[H:20].[H][O:12][O:13][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-R932
[H][C@@:6]([C:5]1:[C:4]([H:15]):[C:3]([H:14]):[C:2]([C:1]([H:24])([H:25])[H:26]):[C:10]([H:23]):[C:9]:1[H:22])([C:7]([H:16])([H:17])[H:18])[N:8]([H:19])[H:20].[O:12]=[O:13].[H][O:11][H]>>[C:1]([C:2]1:[C:3]([H:14]):[C:4]([H:15]):[C:5]([C:6]([C:7]([H:16])([H:17])[H:18])=[O:11]):[C:9]([H:22]):[C:10]:1[H:23])([H:24])([H:25])[H:26].[H][N:8]([H:19])[H:20].[H][O:12][O:13][H]