SMIRKS
N#[C:4][C:2](=[C:1]([H:8])[H:9])[Cl:3]>>[H]O[C:4](=O)[C:2](=[C:1]([H:8])[H:9])[Cl:3]
Derived Operators
EVODEX.1-F492 - Elemental Balance
O | 2 |
N | -1 |
H | 1 |
EVODEX.1-M81 - Mass Difference
18.994529999999997
EVODEX.1-Em690 - Reaction Operator Em
[#7]#[#6:5]-[#6:4]=[#6:3]>>[H]-[#8]-[#6:5](=[#8])-[#6:4]=[#6:3]
Source Full Reactions
EVODEX.1-R6598
[C:1](=[C:2]([Cl:3])[C:4]#[N:5])([H:8])[H:9].[H][O:6][H].[H][O:7][H:12]>>[C:1](=[C:2]([Cl:3])[C:4](=[O:6])[O:7][H:12])([H:8])[H:9].[H][N:5]([H])[H]