Benzene → Ethyl 3-[(4-bromo-2-methylphenyl)amino]-2-nitro-3-oxopropanoate

Reaction equation

[Br:1][c:2]1[cH:3][c:4]([CH3:11])[c:5]([N:8]=[C:9]=[O:10])[cH:6][cH:7]1.[C:21](=[O:22])([O-:23])[O-:24].[K+:25].[K+:26].[N+:12](=[O:13])([O-:14])[CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20].[cH:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[Br:1][c:2]1[cH:3][c:4]([CH3:11])[c:5]([NH:8][C:9](=[O:10])[CH:15]([N+:12](=[O:13])[O-:14])[C:16](=[O:17])[O:18][CH2:19][CH3:20])[cH:6][cH:7]1

Participants

Reactant 5

HCID 241Benzene

HCID 813Potassium Cation2×

HCID 19660Carbonate Ion

HCID 69379Ethyl nitroacetate

HCID 27355944-Bromo-2-methylphenyl isocyanate

Product 1

HCID 19096889Ethyl 3-[(4-bromo-2-methylphenyl)amino]-2-nitro-3-oxopropanoate

Sources & evidence

ORD record: ord-ef1c8bd04b26483ea656ef81f78a480f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…