SMIRKS
[H]N([H])[C:2]1([H])[C:3]([H:15])([H:16])[C:4]([H:17])([H:18])[C:5]2:[C:6]([H:19]):[C:7]([H:20]):[C:8]([H:21]):[C:9]([H:22]):[C:10]:21>>O=[C:2]1[C:3]([H:15])([H:16])[C:4]([H:17])([H:18])[C:5]2:[C:6]([H:19]):[C:7]([H:20]):[C:8]([H:21]):[C:9]([H:22]):[C:10]:21
Derived Operators
EVODEX.1-F72 - Elemental Balance
O | 1 |
N | -1 |
H | -3 |
EVODEX.1-M60 - Mass Difference
-1.0316900000000002
EVODEX.1-E621 - Reaction Operator E
[#6:1]-[#6@:2](-[#7](-[H])-[H])(-[#6:4])-[H]>>[#6:1]-[#6:2](-[#6:4])=[#8]
EVODEX.1-N42 - Reaction Operator N
[H]-[#7](-[H])-[#6@@:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]
EVODEX.1-Em341 - Reaction Operator Em
[H]-[#7](-[H])-[#6:10](-[H])(-[#6:8])-[#6:12]>>[#8]=[#6:10](-[#6:8])-[#6:12]
EVODEX.1-Nm115 - Reaction Operator Nm
[H]-[#7](-[H])-[#6:8](-[H])(-[#6:7])-[#6:10]>>[#8]=[#6:8](-[#6:7])-[#6:10]
Source Full Reactions
EVODEX.1-R935
[H][C:2]1([N:1]([H:23])[H:24])[C:3]([H:15])([H:16])[C:4]([H:17])([H:18])[C:5]2:[C:6]([H:19]):[C:7]([H:20]):[C:8]([H:21]):[C:9]([H:22]):[C:10]:21.[O:12]=[O:13].[H][O:11][H]>>[C:2]1(=[O:11])[C:3]([H:15])([H:16])[C:4]([H:17])([H:18])[C:5]2:[C:6]([H:19]):[C:7]([H:20]):[C:8]([H:21]):[C:9]([H:22]):[C:10]:21.[H][N:1]([H:23])[H:24].[H][O:12][O:13][H]