SMIRKS
[C:1]([N:2]([C:3]([H:16])([H:17])[H:18])[C:4]([C:5]1:[C:6]([H:19]):[C:7]([H:20]):[C:8]([C:9](=[O:10])[H:21]):[C:11]([H:22]):[C:12]:1[H:23])([H:24])[H:25])([H:26])([H:27])[H:28].[H][N:13]([H:29])[H:30]>>[H][C:9]([C:8]1:[C:7]([H:20]):[C:6]([H:19]):[C:5]([C:4]([N:2]([C:1]([H:26])([H:27])[H:28])[C:3]([H:16])([H:17])[H:18])([H:24])[H:25]):[C:12]([H:23]):[C:11]:1[H:22])([N:13]([H:29])[H:30])[H:21].[H][O:10][H]
Derived Operators
EVODEX.1-M3 - Mass Difference
2.01566
EVODEX.1-E12 - Reaction Operator E
[#6:18]-[#6:19](=[#8:20])-[H:31].[#7:23](-[H:42])(-[H:43])-[H]>>[#6:18]-[#6:19](-[#7:23](-[H:42])-[H:43])(-[H:31])-[H].[#8:20](-[H])-[H]
EVODEX.1-N248 - Reaction Operator N
[#6:18]-[#6:19](=[#8:20])-[H:33].[H]-[#7:23](-[H:42])-[H:43]>>[H]-[#6:19](-[#6:18])(-[#7:23](-[H:42])-[H:43])-[H:33].[H]-[#8:20]-[H]
EVODEX.1-Em370 - Reaction Operator Em
[#6:18]-[#6:19]=[#8:20].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23].[H]-[#8:20]-[H]
EVODEX.1-Cm66 - Reaction Operator Cm
[H]-[#7:49].[#6:61]=[#8:62]>>[H]-[#6:61]-[#7:49].[H]-[#8:62]-[H]
EVODEX.1-Nm330 - Reaction Operator Nm
[#6:18]-[#6:19]=[#8:20].[H]-[#7:23]>>[H]-[#6:19](-[#6:18])-[#7:23].[H]-[#8:20]-[H]
Source Full Reactions
EVODEX.1-R989
[C:1]([N:2]([C:3]([H:16])([H:17])[H:18])[C:4]([C:5]1:[C:6]([H:19]):[C:7]([H:20]):[C:8]([C:9](=[O:10])[H:21]):[C:11]([H:22]):[C:12]:1[H:23])([H:24])[H:25])([H:26])([H:27])[H:28].[H][N:13]([H:29])[H:30].[H][O:14][O:15][H]>>[H][C:9]([C:8]1:[C:7]([H:20]):[C:6]([H:19]):[C:5]([C:4]([N:2]([C:1]([H:26])([H:27])[H:28])[C:3]([H:16])([H:17])[H:18])([H:24])[H:25]):[C:12]([H:23]):[C:11]:1[H:22])([N:13]([H:29])[H:30])[H:21].[O:14]=[O:15].[H][O:10][H]