Water → N-(2-(3,3-dimethylbut-1-ynyl)-5-fluoro-4-nitrophenyl)butyramide

HRID 286306Notes

Reaction equation

HRID 286306 reaction equation
[C:25]([CH2:26][CH2:27][CH3:28])(=[O:29])[Cl:30].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:1][C:2]([C:3]#[C:4][c:5]1[c:6]([NH2:7])[cH:8][c:9]([F:15])[c:10]([N+:12](=[O:13])[O-:14])[cH:11]1)([CH3:16])[CH3:17].[Cl:32][CH2:33][Cl:34].[OH2:31]>>[CH3:1][C:2]([C:3]#[C:4][c:5]1[c:6]([NH:7][C:25]([CH2:26][CH2:27][CH3:28])=[O:29])[cH:8][c:9]([F:15])[c:10]([N+:12](=[O:13])[O-:14])[cH:11]1)([CH3:16])[CH3:17]

Participants

6

Sources & evidence

ORD record
ord-17c59e90cba644ae8b142f2713c94b99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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