SMIRKS
[H]OC(=O)[C@@]1([H])N([C:3]([C:2]([N:1]([H:24])[H:25])([H:22])[H:23])=[O:4])C([H])([H])C([H])([H])C1([H])[H]>>[H]O[C:3]([C:2]([N:1]([H:24])[H:25])([H:22])[H:23])=[O:4]
Derived Operators
EVODEX.1-F278 - Elemental Balance
| O | -1 |
| C | -5 |
| N | -1 |
| H | -7 |
EVODEX.1-M142 - Mass Difference
-97.05281
EVODEX.1-E1032 - Reaction Operator E
[#8]=[#6](-[#8]-[H])-[#6]1(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#7]-1-[#6:10](=[#8:11])-[#6:12]>>[#8](-[#6:10](=[#8:11])-[#6:12])-[H]
EVODEX.1-C593 - Reaction Operator C
[H]-[#8]-[#6](=[#8])-[#6]1(-[H])-[#7](-[#6:2])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6]-1(-[H])-[H]>>[H]-[#8]-[#6:2]
EVODEX.1-N749 - Reaction Operator N
[H]-[#8]-[#6](=[#8])-[#6]1(-[H])-[#7](-[#6:2](-[#6:1])=[#8:3])-[#6](-[H])(-[H])-[#6](-[H])(-[H])-[#6]-1(-[H])-[H]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3]
EVODEX.1-Em53 - Reaction Operator Em
[#6]-[#7](-[#6:2](-[#6:1])=[#8:3])-[#6]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3]
EVODEX.1-Nm60 - Reaction Operator Nm
[#6]-[#7](-[#6:2](-[#6:1])=[#8:3])-[#6]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3]
Source Full Reactions
EVODEX.1-R5572
[N:1]([C:2]([C:3](=[O:4])[N:5]1[C:6]([H:14])([H:15])[C:7]([H:16])([H:17])[C:8]([H:18])([H:19])[C@:9]1([C:10](=[O:11])[O:12][H:20])[H:21])([H:22])[H:23])([H:24])[H:25].[H][O:13][H:26]>>[N:1]([C:2]([C:3](=[O:4])[O:13][H:26])([H:22])[H:23])([H:24])[H:25].[H][N:5]1[C:6]([H:14])([H:15])[C:7]([H:16])([H:17])[C:8]([H:18])([H:19])[C@:9]1([C:10](=[O:11])[O:12][H:20])[H:21]