SMIRKS
[H][O:1][H:21].[O:2]([C:3]([C@:4]1([H:23])[O:5][C@:6]([O:7][C:8]2:[C:9]([Cl:10]):[C:11]([H:24]):[C:12]([Cl:13]):[C:14]([H:25]):[C:15]:2[Cl:16])([H:26])[C@@:17]([O:18][H:27])([H:28])[C@:19]1([O:20][H:29])[H:30])([H:31])[H:32])[H:33]>>[O:1]([C@:6]1([H:26])[O:5][C@:4]([C:3]([O:2][H:33])([H:31])[H:32])([H:23])[C@@:19]([O:20][H:29])([H:30])[C@:17]1([O:18][H:27])[H:28])[H:21].[H][O:7][C:8]1:[C:9]([Cl:10]):[C:11]([H:24]):[C:12]([Cl:13]):[C:14]([H:25]):[C:15]:1[Cl:16]
Derived Operators
EVODEX.1-C538 - Reaction Operator C
[H]-[#8:1].[#8:7]-[#6@:6]-[#6@@:35]-[#6@:37]>>[#8:1]-[#6@@:6]-[#6@:35]-[#6@@:37].[H]-[#8:7]
EVODEX.1-N686 - Reaction Operator N
[H]-[#8:1]-[H:39].[#8:5]1-[#6@:4]-[#6@@:37](-[#6@:35](-[#6@@:6]-1(-[#8:7]-[#6:8])-[H:67])(-[#8:36])-[H:69])(-[#8:38])-[H:71]>>[#8:1](-[#6@@:6]1(-[H:67])-[#8:5]-[#6@:4]-[#6@@:37](-[#8:38])(-[H:71])-[#6@:35]-1(-[#8:36])-[H:69])-[H:39].[H]-[#8:7]-[#6:8]
EVODEX.1-Em32 - Reaction Operator Em
[H]-[#8:1].[#8:10]-[#6:11](-[#8:12]-[#6:13])-[#6:24]>>[H]-[#8:12]-[#6:13].[#8:1]-[#6:11](-[#8:10])-[#6:24]
EVODEX.1-Nm33 - Reaction Operator Nm
[H]-[#8:1].[#8:10]-[#6:11](-[#8:12]-[#6:13])-[#6:24]>>[H]-[#8:12]-[#6:13].[#8:1]-[#6:11](-[#8:10])-[#6:24]
Source Full Reactions
EVODEX.1-R5349
[H][O:1][H:21].[O:2]([C:3]([C@:4]1([H:23])[O:5][C@:6]([O:7][C:8]2:[C:9]([Cl:10]):[C:11]([H:24]):[C:12]([Cl:13]):[C:14]([H:25]):[C:15]:2[Cl:16])([H:26])[C@@:17]([O:18][H:27])([H:28])[C@:19]1([O:20][H:29])[H:30])([H:31])[H:32])[H:33]>>[O:1]([C@:6]1([H:26])[O:5][C@:4]([C:3]([O:2][H:33])([H:31])[H:32])([H:23])[C@@:19]([O:20][H:29])([H:30])[C@:17]1([O:18][H:27])[H:28])[H:21].[H][O:7][C:8]1:[C:9]([Cl:10]):[C:11]([H:24]):[C:12]([Cl:13]):[C:14]([H:25]):[C:15]:1[Cl:16]