SMIRKS
[Cl:1][C:2]1=[C:3]([Cl:4])[C:5]2([Cl:6])[C:7]3([H:20])[C:8]([H:21])([H:22])[C:9]4([H:23])[O:10][C:11]4([H:24])[C:12]([H:25])([H:26])[C:13]3([H:27])[C:14]1([Cl:15])[C:16]2([Cl:17])[Cl:18]>>[H]O[C:11]1([H:24])[C@@:9]([O:10][H])([H:23])[C:8]([H:21])([H:22])[C:7]2([H:20])[C:5]3([Cl:6])[C:3]([Cl:4])=[C:2]([Cl:1])[C:14]([Cl:15])([C:13]2([H:27])[C:12]1([H:25])[H:26])[C:16]3([Cl:17])[Cl:18]
Derived Operators
EVODEX.1-M2 - Mass Difference
18.010559999999998
EVODEX.1-E378 - Reaction Operator E
[#6:5]-[#6@@:6]1(-[H:21])-[#8:7]-[#6@:8]-1(-[#6:9])-[H:29]>>[#6:5]-[#6@:6](-[#6@@:8](-[#8:7]-[H])(-[#6:9])-[H:29])(-[#8]-[H])-[H:21]
EVODEX.1-C899 - Reaction Operator C
[#8:7]1-[#6@@:6]-[#6@:8]-1>>[H]-[#8]-[#6@:6]-[#6@@:8]-[#8:7]-[H]
EVODEX.1-N1133 - Reaction Operator N
[#6:5]-[#6@@:6]1(-[H:21])-[#8:7]-[#6@:8]-1(-[#6:9])-[H:29]>>[H]-[#8]-[#6@:6](-[#6:5])(-[#6@@:8](-[#8:7]-[H])(-[#6:9])-[H:29])-[H:21]
EVODEX.1-Em125 - Reaction Operator Em
[#6:5]-[#6:6]1-[#8:7]-[#6:8]-1>>[H]-[#8]-[#6:6](-[#6:5])-[#6:8]-[#8:7]-[H]
EVODEX.1-Nm159 - Reaction Operator Nm
[#6:5]-[#6:6]1-[#8:7]-[#6:8]-1>>[H]-[#8]-[#6:6](-[#6:5])-[#6:8]-[#8:7]-[H]
Source Full Reactions
EVODEX.1-R5396
[Cl:1][C:2]1=[C:3]([Cl:4])[C:5]2([Cl:6])[C:7]3([H:20])[C:8]([H:21])([H:22])[C:9]4([H:23])[O:10][C:11]4([H:24])[C:12]([H:25])([H:26])[C:13]3([H:27])[C:14]1([Cl:15])[C:16]2([Cl:17])[Cl:18].[H][O:19][H:28]>>[H][O:10][C@:9]1([H:23])[C:8]([H:21])([H:22])[C:7]2([H:20])[C:5]3([Cl:6])[C:3]([Cl:4])=[C:2]([Cl:1])[C:14]([Cl:15])([C:13]2([H:27])[C:12]([H:25])([H:26])[C:11]1([O:19][H:28])[H:24])[C:16]3([Cl:17])[Cl:18]