SMIRKS
[H][C:7]([C:6]([C:5]([N:4]([C:2]([C:1]([H:35])([H:36])[H:37])=[O:3])[H:34])([H:32])[H:33])([H:30])[H:31])([N:8]([C:9]([C:10]([C:11]([C:12]([N:13]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27])[H:28].[O:15]=[O:16]>>O=[C:7]([C:6]([C:5]([N:4]([C:2]([C:1]([H:35])([H:36])[H:37])=[O:3])[H:34])([H:32])[H:33])([H:30])[H:31])[H:28].[H][N:8]([C:9]([C:10]([C:11]([C:12]([N:13]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27].[H][O:15][O:16][H]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E382 - Reaction Operator E
[#6:1]-[#6:2](-[#7:3](-[#6:4])-[H:28])(-[H:29])-[H].[#8:14]=[#8:15]>>[#6:1]-[#6:2](=[#8])-[H:29].[#7:3](-[#6:4])(-[H:28])-[H].[#8:14](-[#8:15]-[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-N255 - Reaction Operator N
[H]-[#6:7](-[#7:6](-[#6:5])-[H:22])(-[#6:8])-[H:20].[#8:12]=[#8:13]>>[#8]=[#6:7](-[#6:8])-[H:20].[H]-[#7:6](-[#6:5])-[H:22].[H]-[#8:12]-[#8:13]-[H]
EVODEX.1-Em377 - Reaction Operator Em
[H]-[#6:7](-[#7:6]-[#6:5])-[#6:8].[#8:12]=[#8:13]>>[#8]=[#6:7]-[#6:8].[H]-[#7:6]-[#6:5].[H]-[#8:12]-[#8:13]-[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-Nm337 - Reaction Operator Nm
[H]-[#6:7](-[#7:6]-[#6:5])-[#6:8].[#8:12]=[#8:13]>>[#8]=[#6:7]-[#6:8].[H]-[#7:6]-[#6:5].[H]-[#8:12]-[#8:13]-[H]
Source Full Reactions
EVODEX.1-R1090
[H][C:7]([C:6]([C:5]([N:4]([C:2]([C:1]([H:35])([H:36])[H:37])=[O:3])[H:34])([H:32])[H:33])([H:30])[H:31])([N:8]([C:9]([C:10]([C:11]([C:12]([N:13]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27])[H:28].[O:15]=[O:16].[H][O:14][H]>>[C:1]([C:2](=[O:3])[N:4]([C:5]([C:6]([C:7](=[O:14])[H:28])([H:30])[H:31])([H:32])[H:33])[H:34])([H:35])([H:36])[H:37].[H][N:8]([C:9]([C:10]([C:11]([C:12]([N:13]([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])[H:27].[H][O:15][O:16][H]