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EVODEX.1-P5285

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][C:3]1([H:16])[C:2](=[O:1])[C:6]([H:22])([H:23])[C:5]([H:20])([H:21])[C:4]1([H:18])[H:19].[O:7]=[C:8]([C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]>>[H][O:7][C@:8]([C@@:3]1([H:16])[C:2](=[O:1])[C:6]([H:22])([H:23])[C:5]([H:20])([H:21])[C:4]1([H:18])[H:19])([C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E194 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1]-[#6:2](=[#8:3])-[H:11].[#6:4]-[#6:5](-[#6:6])(-[H:16])-[H]>>[#6:1]-[#6:2](-[#8:3]-[H])(-[#6:5](-[#6:4])(-[#6:6])-[H:16])-[H:11]

EVODEX.1-C8 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#6:1].[#6:12]=[#8:13]>>[H]-[#8:13]-[#6:12]-[#6:1]

EVODEX.1-N816 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:1]-[#6:2](=[#8:3])-[H:11].[H]-[#6:5](-[#6:4])(-[#6:6])-[H:16]>>[H]-[#8:3]-[#6:2](-[#6:1])(-[#6:5](-[#6:4])(-[#6:6])-[H:16])-[H:11]

EVODEX.1-Em657 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2]=[#8:3].[H]-[#6:5](-[#6:4])-[#6:6]>>[H]-[#8:3]-[#6:2](-[#6:1])-[#6:5](-[#6:4])-[#6:6]

EVODEX.1-Cm42 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#6:1].[#6:12]=[#8:13]>>[H]-[#8:13]-[#6:12]-[#6:1]

EVODEX.1-Nm590 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2]=[#8:3].[H]-[#6:5](-[#6:4])-[#6:6]>>[H]-[#8:3]-[#6:2](-[#6:1])-[#6:5](-[#6:4])-[#6:6]

Source Full Reactions

EVODEX.1-R6045

Full Reaction Rendering

[H][C:3]1([H:16])[C:2](=[O:1])[C:6]([H:22])([H:23])[C:5]([H:20])([H:21])[C:4]1([H:18])[H:19].[O:7]=[C:8]([C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]>>[H][O:7][C@:8]([C@@:3]1([H:16])[C:2](=[O:1])[C:6]([H:22])([H:23])[C:5]([H:20])([H:21])[C:4]1([H:18])[H:19])([C:9]1:[C:10]([H:24]):[C:11]([H:25]):[C:12]([Cl:13]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]