Benzene → HCID 69181424, compound

HRID 293247Notes

Reaction equation

HRID 293247 reaction equation
[C:20]([CH2:21][C:22](=[O:23])[CH3:24])(=[O:25])[O:26][CH2:27][CH3:28].[CH3:12][c:13]1[cH:14][cH:15][c:16]([NH2:17])[cH:18][cH:19]1.[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1.[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[CH3:12][c:13]1[cH:14][cH:15][c:16]([NH:17][C:22](=[CH:21][C:20](=[O:25])[O:26][CH2:27][CH3:28])[CH3:24])[cH:18][cH:19]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 6101p-Toluenesulfonic acidHCID 7813p-ToluidineHCID 8868Ethyl Acetoacetate

Product 1

HCID 69181424HCID 69181424, compound

Sources & evidence

ORD record
ord-9b516e0323b64184adee6eab6ca4ebbf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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