SMIRKS
Cl[C:2]([C:3]([O:4][C:5]([C:6]([Cl:7])([H:9])[H:10])([H:11])[H:12])([H:13])[H:14])([H:15])[H:16]>>[H]O[C:2]([C:3]([O:4][C:5]([C:6]([Cl:7])([H:9])[H:10])([H:11])[H:12])([H:13])[H:14])([H:15])[H:16]
Derived Operators
EVODEX.1-F543 - Elemental Balance
Cl | -1 |
O | 1 |
H | 1 |
EVODEX.1-M170 - Mass Difference
-17.966169999999998
EVODEX.1-E1362 - Reaction Operator E
[#6:13]-[#6:14](-[#17])(-[H:17])-[H:18]>>[#6:13]-[#6:14](-[#8]-[H])(-[H:17])-[H:18]
EVODEX.1-N902 - Reaction Operator N
[#17]-[#6:2](-[#6:3])(-[H:15])-[H:16]>>[H]-[#8]-[#6:2](-[#6:3])(-[H:15])-[H:16]
Source Full Reactions
EVODEX.1-R6723
[Cl:1][C:2]([C:3]([O:4][C:5]([C:6]([Cl:7])([H:9])[H:10])([H:11])[H:12])([H:13])[H:14])([H:15])[H:16].[H][O:8][H:17]>>[C:2]([C:3]([O:4][C:5]([C:6]([Cl:7])([H:9])[H:10])([H:11])[H:12])([H:13])[H:14])([O:8][H:17])([H:15])[H:16].[H][Cl:1]