SMIRKS
Cl[C:2]1([H:8])[C:3]([H:9])([H:10])[C:4]([H:11])([H:12])[C:5]([H:13])([H:14])[C:6]1([H:15])[H:16]>>[H]O[C:2]1([H:8])[C:3]([H:9])([H:10])[C:4]([H:11])([H:12])[C:5]([H:13])([H:14])[C:6]1([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-E1363 - Reaction Operator E
[#6:1]-[#6:2](-[#6:3])(-[#17])-[H:9]>>[#6:1]-[#6:2](-[#6:3])(-[#8]-[H])-[H:9]
EVODEX.1-N899 - Reaction Operator N
[#17]-[#6@@:8](-[H:16])(-[#6@:6])-[#6@@:10]>>[H]-[#8]-[#6@@:8](-[H:16])(-[#6@:6])-[#6@@:10]
EVODEX.1-Em707 - Reaction Operator Em
[#17]-[#6:8](-[#6:6])-[#6:10]>>[H]-[#8]-[#6:8](-[#6:6])-[#6:10]
EVODEX.1-Nm636 - Reaction Operator Nm
[#17]-[#6:8](-[#6:6])-[#6:10]>>[H]-[#8]-[#6:8](-[#6:6])-[#6:10]
Source Full Reactions
EVODEX.1-R6706
[Cl:1][C:2]1([H:8])[C:3]([H:9])([H:10])[C:4]([H:11])([H:12])[C:5]([H:13])([H:14])[C:6]1([H:15])[H:16].[H][O:7][H:17]>>[C:2]1([O:7][H:17])([H:8])[C:3]([H:9])([H:10])[C:4]([H:11])([H:12])[C:5]([H:13])([H:14])[C:6]1([H:15])[H:16].[H][Cl:1]