SMIRKS
[H][C:8]1([N:7]([H:28])[H:29])[C:9]([H:19])([H:20])[C:10]([H:21])([H:22])[C:11]([H:23])([H:24])[N:12]([H:25])[C:13]1([H:26])[H:27]>>[H]OC(=O)C([H])(C([H])([H])[H])[N:7]([H:28])[H:29].O=[C:8]1[C:9]([H:19])([H:20])[C:10]([H:21])([H:22])[C:11]([H:23])([H:24])[N:12]([H:25])[C:13]1([H:26])[H:27]
Derived Operators
EVODEX.1-F56 - Elemental Balance
| O | 3 |
| C | 3 |
| H | 4 |
EVODEX.1-M31 - Mass Difference
88.01602
EVODEX.1-E588 - Reaction Operator E
[#7:7](-[#6@:8](-[#6:9])(-[#6:15])-[H])(-[H:35])-[H:36]>>[#6](-[#6@@](-[#6](=[#8])-[#8]-[H])(-[#7:7](-[H:35])-[H:36])-[H])(-[H])(-[H])-[H].[#8]=[#6:8](-[#6:9])-[#6:15]
EVODEX.1-C124 - Reaction Operator C
[H]-[#6@@:8]-[#7:7]>>[H]-[#8]-[#6](=[#8])-[#6@](-[H])(-[#6](-[H])(-[H])-[H])-[#7:7].[#8]=[#6:8]
EVODEX.1-N537 - Reaction Operator N
[H]-[#6@@:8](-[#7:7](-[H:35])-[H:36])(-[#6:9])-[#6:15]>>[H]-[#8]-[#6](=[#8])-[#6@](-[H])(-[#6](-[H])(-[H])-[H])-[#7:7](-[H:35])-[H:36].[#8]=[#6:8](-[#6:9])-[#6:15]
EVODEX.1-Em110 - Reaction Operator Em
[H]-[#6:39](-[#7:40])(-[#6:5])-[#6:37]>>[#8]=[#6:39](-[#6:5])-[#6:37].[#6]-[#6](-[H])(-[#6])-[#7:40]
EVODEX.1-Nm13 - Reaction Operator Nm
[H]-[#6:39](-[#7:40])(-[#6:5])-[#6:37]>>[#8]=[#6:39](-[#6:5])-[#6:37].[#6]-[#6](-[H])(-[#6])-[#7:40]
Source Full Reactions
EVODEX.1-R3576
[C:1]([C:2](=[O:3])[C:4](=[O:5])[O:6][H:14])([H:15])([H:16])[H:17].[H][C:8]1([N:7]([H:28])[H:29])[C:9]([H:19])([H:20])[C:10]([H:21])([H:22])[C:11]([H:23])([H:24])[N:12]([H:25])[C:13]1([H:26])[H:27]>>[H][C:2]([C:1]([H:15])([H:16])[H:17])([C:4](=[O:5])[O:6][H:14])[N:7]([H:28])[H:29].[O:3]=[C:8]1[C:9]([H:19])([H:20])[C:10]([H:21])([H:22])[C:11]([H:23])([H:24])[N:12]([H:25])[C:13]1([H:26])[H:27]