SMIRKS
N#[C:5][C:3](=[C:2]([C:1]([H:12])([H:13])[H:14])[H:11])[N:4]([H:9])[H:10].[H][O:7][H]>>[H]O[C:5]([C:3](=[C:2]([C:1]([H:12])([H:13])[H:14])[H:11])[N:4]([H:9])[H:10])=[O:7]
Derived Operators
EVODEX.1-F74 - Elemental Balance
O | 1 |
N | -1 |
H | -1 |
EVODEX.1-M17 - Mass Difference
0.9839699999999996
EVODEX.1-N56 - Reaction Operator N
[#7]#[#6:4]-[#6:2].[H]-[#8:6]-[H]>>[H]-[#8]-[#6:4](-[#6:2])=[#8:6]
EVODEX.1-Em689 - Reaction Operator Em
[#7]#[#6:4]-[#6:2]=[#6:1].[H]-[#8:6]-[H]>>[H]-[#8]-[#6:4](-[#6:2]=[#6:1])=[#8:6]
EVODEX.1-Nm87 - Reaction Operator Nm
[#7]#[#6:4]-[#6:2].[H]-[#8:6]-[H]>>[H]-[#8]-[#6:4](-[#6:2])=[#8:6]
Source Full Reactions
EVODEX.1-R6597
[C:1]([C:2](=[C:3]([N:4]([H:9])[H:10])[C:5]#[N:6])[H:11])([H:12])([H:13])[H:14].[H][O:7][H].[H][O:8][H:17]>>[C:1]([C:2](=[C:3]([N:4]([H:9])[H:10])[C:5](=[O:7])[O:8][H:17])[H:11])([H:12])([H:13])[H:14].[H][N:6]([H])[H]