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EVODEX.1-P6208

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

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

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E117 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1](-[#7:2])(-[H:14])(-[H:15])-[H].[#8:5]=[#6:6](-[#6:7])-[H:22]>>[#6:1](-[#7:2])(-[#6@@:6](-[#8:5]-[H])(-[#6:7])-[H:22])(-[H:14])-[H:15]

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-N918 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#6:1](-[#7:2])(-[H:12])-[H:13].[#8:5]=[#6:6](-[#6:7])-[H:18]>>[H]-[#8:5]-[#6@@:6](-[#6:1](-[#7:2])(-[H:12])-[H:13])(-[#6:7])-[H:18]

EVODEX.1-Em727 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#6:1]-[#7:2].[#8:5]=[#6:6]-[#6:7]>>[H]-[#8:5]-[#6:6](-[#6:1]-[#7:2])-[#6:7]

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-Nm656 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#6:1]-[#7:2].[#8:5]=[#6:6]-[#6:7]>>[H]-[#8:5]-[#6:6](-[#6:1]-[#7:2])-[#6:7]

Source Full Reactions

EVODEX.1-R6814

Full Reaction Rendering

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