SMIRKS
Cl[C:3]([C:2]([C:1]([H:10])([H:11])[H:12])([H:8])[H:9])([H:6])[H:7]>>[H]O[C:3]([C:2]([C:1]([H:10])([H:11])[H:12])([H:8])[H:9])([H:6])[H:7]
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-R6717
[C:1]([C:2]([C:3]([Cl:4])([H:6])[H:7])([H:8])[H:9])([H:10])([H:11])[H:12].[H][O:5][H:13]>>[C:1]([C:2]([C:3]([O:5][H:13])([H:6])[H:7])([H:8])[H:9])([H:10])([H:11])[H:12].[H][Cl:4]