EVODEX Logo

EVODEX.1-P5654

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([O:5][H:7])[H:8])([H:9])([H:10])[H:11]>>[H]O[C:2]([C:1]([H:9])([H:10])[H:11])=[O:3].[H][N:4]([O:5][H:7])[H:8]

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E373 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10](-[#8:11])-[H:63]>>[#7:10](-[#8:11])(-[H:63])-[H].[#6:7]-[#6:8](=[#8:9])-[#8]-[H]

EVODEX.1-C23 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[H]-[#8]-[#6:5]

EVODEX.1-N1151 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4](-[#8:5])-[H:8]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4](-[#8:5])-[H:8]

EVODEX.1-Em662 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4]-[#8:5]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4]-[#8:5]

EVODEX.1-Cm18 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:4]-[#6:5]>>[H]-[#7:4].[#8]-[#6:5]

EVODEX.1-Nm595 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#7:4]-[#8:5]>>[H]-[#8]-[#6:2](-[#6:1])=[#8:3].[H]-[#7:4]-[#8:5]

Source Full Reactions

EVODEX.1-R6374

Full Reaction Rendering

[C:1]([C:2](=[O:3])[N:4]([O:5][H:7])[H:8])([H:9])([H:10])[H:11].[H][O:6][H:12]>>[C:1]([C:2](=[O:3])[O:6][H:12])([H:9])([H:10])[H:11].[H][N:4]([O:5][H:7])[H:8]