SMIRKS
[H][C:2]([N:1]([H:29])[H:30])([C:3]1:[C:4]([H:19]):[C:5]([H:20]):[C:6]([H:21]):[C:7]([H:22]):[C:8]:1[H:23])[C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27]>>O=[C:2]([C:3]1:[C:4]([H:19]):[C:5]([H:20]):[C:6]([H:21]):[C:7]([H:22]):[C:8]:1[H:23])[C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27].[H][N:1]([H:29])[H:30]
Derived Operators
EVODEX.1-M6 - Mass Difference
15.9949
EVODEX.1-E421 - Reaction Operator E
[#6:13]-[#6@:14](-[#7:15](-[H:27])-[H:28])(-[#6:16])-[H].[#6:1]-[#6@:2](-[#7:3](-[H:40])-[H:41])(-[#6:4])-[H]>>[#6:13]-[#6:14](-[#6:16])=[#8].[#6:1]-[#6:2](-[#6:4])=[#8].[#7:15](-[H:27])(-[H:28])-[H].[#7:3](-[H:40])(-[H:41])-[H]
EVODEX.1-N40 - Reaction Operator N
[H]-[#6:2](-[#7:1](-[H:29])-[H:30])(-[#6:3])-[#6:9]>>[#8]=[#6:2](-[#6:3])-[#6:9].[H]-[#7:1](-[H:29])-[H:30]
EVODEX.1-Em336 - Reaction Operator Em
[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:9]>>[#8]=[#6:2](-[#6:3])-[#6:9].[H]-[#7:1]
EVODEX.1-Nm113 - Reaction Operator Nm
[H]-[#6:2](-[#7:1])(-[#6:3])-[#6:9]>>[#8]=[#6:2](-[#6:3])-[#6:9].[H]-[#7:1]
Source Full Reactions
EVODEX.1-R1007
[H][C:2]([N:1]([H:29])[H:30])([C:3]1:[C:4]([H:19]):[C:5]([H:20]):[C:6]([H:21]):[C:7]([H:22]):[C:8]:1[H:23])[C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27].[O:17]=[O:18].[H][O:16][H]>>[C:2]([C:3]1:[C:4]([H:19]):[C:5]([H:20]):[C:6]([H:21]):[C:7]([H:22]):[C:8]:1[H:23])([C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27])=[O:16].[H][N:1]([H:29])[H:30].[H][O:17][O:18][H]