Potassium Cation → 3-[4-(3-Benzyloxyphenyl)-2-oxo-pyrrolidin-1-yl]benzonitrile

HRID 282133Notes

Reaction equation

HRID 282133 reaction equation
[Br:21][c:22]1[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29]1.[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH:15]2[CH2:16][C:17](=[O:20])[NH:18][CH2:19]2)[cH:12][cH:13][cH:14]1.[CH3:59][CH2:60][O:61][C:62]([CH3:63])=[O:64].[CH:38]1([NH2:39])[CH2:40][CH2:41][CH2:42][CH2:43][CH:44]1[NH2:45].[Cu:57][I:58].[K+:35].[K+:36].[K+:37].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[P:30]([O-:31])([O-:32])([O-:33])=[O:34]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([CH:15]2[CH2:16][C:17](=[O:20])[N:18]([c:22]3[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29]3)[CH2:19]2)[cH:12][cH:13][cH:14]1

Participants

10

Reactant 9

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 46101,2-DiaminocyclohexaneHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 233813-BromobenzonitrileHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 688307524-[3-(Benzyloxy)phenyl]pyrrolidin-2-one

Product 1

HCID 688298583-[4-(3-Benzyloxyphenyl)-2-oxo-pyrrolidin-1-yl]benzonitrile

Sources & evidence

ORD record
ord-d92af5a2a7da4d208840425288446a81
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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