SMIRKS
[C:1](=[C:2]([Cl:3])[C:4]#[N:5])([H:8])[H:9].[H][O:6][H]>>[H]O[C:4]([C:2](=[C:1]([H:8])[H:9])[Cl:3])=[O:6].[H][N:5]([H])[H]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-C137 - Reaction Operator C
[#6:5]#[#7:6].[H]-[#8:7]-[H]>>[H]-[#8]-[#6:5]=[#8:7].[H]-[#7:6](-[H])-[H]
EVODEX.1-N58 - Reaction Operator N
[#6:4]-[#6:5]#[#7:6].[H]-[#8:7]-[H]>>[H]-[#8]-[#6:5](-[#6:4])=[#8:7].[H]-[#7:6](-[H])-[H]
EVODEX.1-Em685 - Reaction Operator Em
[#6:3]=[#6:4]-[#6:5]#[#7:6].[H]-[#8:7]-[H]>>[H]-[#8]-[#6:5](-[#6:4]=[#6:3])=[#8:7].[H]-[#7:6](-[H])-[H]
EVODEX.1-Cm106 - Reaction Operator Cm
[#6:5]#[#7:6].[H]-[#8:7]-[H]>>[#8]-[#6:5]=[#8:7].[H]-[#7:6](-[H])-[H]
EVODEX.1-Nm89 - Reaction Operator Nm
[#6:4]-[#6:5]#[#7:6].[H]-[#8:7]-[H]>>[H]-[#8]-[#6:5](-[#6:4])=[#8:7].[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]