SMIRKS
[C:1](=[C:2]([Cl:3])[C:4]#[N:5])([H:8])[H:9]>>[H]O[C:4](=O)[C:2](=[C:1]([H:8])[H:9])[Cl:3].[H][N:5]([H])[H]
Derived Operators
EVODEX.1-M21 - Mass Difference
36.021119999999996
EVODEX.1-N57 - Reaction Operator N
[#6:2]-[#6:4]#[#7:5]>>[H]-[#8]-[#6:4](=[#8])-[#6:2].[H]-[#7:5](-[H])-[H]
EVODEX.1-Em691 - Reaction Operator Em
[#6:1]=[#6:2]-[#6:4]#[#7:5]>>[H]-[#8]-[#6:4](=[#8])-[#6:2]=[#6:1].[H]-[#7:5](-[H])-[H]
EVODEX.1-Nm88 - Reaction Operator Nm
[#6:3]-[#6:5]#[#7:6]>>[H]-[#8]-[#6:5](=[#8])-[#6:3].[H]-[#7:6](-[H])-[H]
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]