Dimethylformamide → 2-[3',5'-Dichloro-4'-(1-cyclohexyl-2-oxo-pyrrolidin-3-ylmethyl)-biphenyl-4-yloxy]-2-methyl-propionic acid ethyl ester

HRID 698387Notes

Reaction equation

HRID 698387 reaction equation
[Br:29][C:30]([C:31](=[O:32])[O:33][CH2:34][CH3:35])([CH3:36])[CH3:37].[C:38](=[O:39])([O-:40])[O-:41].[CH:1]1([N:7]2[C:8](=[O:28])[CH:9]([CH2:12][c:13]3[c:14]([Cl:27])[cH:15][c:16](-[c:20]4[cH:21][cH:22][c:23]([OH:26])[cH:24][cH:25]4)[cH:17][c:18]3[Cl:19])[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cs+:42].[Cs+:43].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[CH:1]1([N:7]2[C:8](=[O:28])[CH:9]([CH2:12][c:13]3[c:14]([Cl:27])[cH:15][c:16](-[c:20]4[cH:21][cH:22][c:23]([O:26][C:30]([C:31](=[O:32])[O:33][CH2:34][CH3:35])([CH3:36])[CH3:37])[cH:24][cH:25]4)[cH:17][c:18]3[Cl:19])[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 11745Propanoic acid, 2-bromo-2-methyl-, ethyl esterHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 592993351-Cyclohexyl-3-(3,5-dichloro-4'-hydroxy-biphenyl-4-ylmethyl)-pyrrolidin-2-one

Product 1

HCID 116062232-[3',5'-Dichloro-4'-(1-cyclohexyl-2-oxo-pyrrolidin-3-ylmethyl)-biphenyl-4-yloxy]-2-methyl-propionic acid ethyl ester

Sources & evidence

ORD record
ord-57d26420d92f46dcbca57189dd0315cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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