SMIRKS
[H][C:14]([C:13]([C:12]([C:11]([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([N:2]([C:1]([H:59])([H:60])[H:61])[C:16]([C:17]1:[C:18]([H:52]):[C:19]([H:53]):[C:20]([H:54]):[C:21]([H:55]):[C:22]:1[H:56])([H:57])[H:58])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])([H:42])[H:43])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([N:15]([H:26])[H:27])[H:28].[O:24]=[O:25]>>O=[C:14]([C:13]([C:12]([C:11]([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([N:2]([C:1]([H:59])([H:60])[H:61])[C:16]([C:17]1:[C:18]([H:52]):[C:19]([H:53]):[C:20]([H:54]):[C:21]([H:55]):[C:22]:1[H:56])([H:57])[H:58])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])([H:42])[H:43])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])[H:28].[H][N:15]([H:26])[H:27].[H][O:24][O:25][H]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E362 - Reaction Operator E
[#6:2]-[#6:4](-[#7:5](-[H:10])-[H:11])(-[H:12])-[H].[#8:7]=[#8:8]>>[#6:2]-[#6:4](=[#8])-[H:12].[#7:5](-[H:10])(-[H:11])-[H].[#8:7](-[#8:8]-[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-N241 - Reaction Operator N
[H]-[#6:2](-[#7:1](-[H:16])-[H:17])(-[#6:3])-[H:14].[#8:7]=[#8:8]>>[#8]=[#6:2](-[#6:3])-[H:14].[H]-[#7:1](-[H:16])-[H:17].[H]-[#8:7]-[#8:8]-[H]
EVODEX.1-Em363 - Reaction Operator Em
[H]-[#6:2](-[#7:1])-[#6:3].[#8:7]=[#8:8]>>[#8]=[#6:2]-[#6:3].[H]-[#7:1].[H]-[#8:7]-[#8:8]-[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-Nm323 - Reaction Operator Nm
[H]-[#6:2](-[#7:1])-[#6:3].[#8:7]=[#8:8]>>[#8]=[#6:2]-[#6:3].[H]-[#7:1].[H]-[#8:7]-[#8:8]-[H]
Source Full Reactions
EVODEX.1-R1010
[H][C:14]([C:13]([C:12]([C:11]([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([N:2]([C:1]([H:59])([H:60])[H:61])[C:16]([C:17]1:[C:18]([H:52]):[C:19]([H:53]):[C:20]([H:54]):[C:21]([H:55]):[C:22]:1[H:56])([H:57])[H:58])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([H:44])[H:45])([H:42])[H:43])([H:40])[H:41])([H:38])[H:39])([H:36])[H:37])([H:34])[H:35])([H:32])[H:33])([H:30])[H:31])([N:15]([H:26])[H:27])[H:28].[O:24]=[O:25].[H][O:23][H]>>[C:1]([N:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([C:14](=[O:23])[H:28])([H:30])[H:31])([H:32])[H:33])([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[C:16]([C:17]1:[C:18]([H:52]):[C:19]([H:53]):[C:20]([H:54]):[C:21]([H:55]):[C:22]:1[H:56])([H:57])[H:58])([H:59])([H:60])[H:61].[H][N:15]([H:26])[H:27].[H][O:24][O:25][H]