Acetate → 7-Chloro-5-(4-methoxy-benzyloxy)-2-(4-trifluoromethoxy-benzyl)-2,3-dihydro-isoindol-1-one

HRID 293258Notes

Reaction equation

HRID 293258 reaction equation
[Br:14][c:15]1[cH:16][c:17]2[c:21]([c:22]([Cl:24])[cH:23]1)[C:20](=[O:25])[N:19]([CH2:26][c:27]1[cH:28][cH:29][c:30]([O:33][C:34]([F:35])([F:36])[F:37])[cH:31][cH:32]1)[CH2:18]2.[C:1](=[O:2])([O-:3])[O-:4].[C:53]([O-:54])(=[O:55])[CH3:56].[C:58]([O-:59])(=[O:60])[CH3:61].[CH3:38][O:39][c:40]1[cH:41][cH:42][c:43]([CH2:44][OH:45])[cH:46][cH:47]1.[CH3:48][CH2:49][O:50][CH2:51][CH3:52].[CH3:7][c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[Cs+:5].[Cs+:6].[Pd+2:57]>>[c:15]1([O:45][CH2:44][c:43]2[cH:42][cH:41][c:40]([O:39][CH3:38])[cH:47][cH:46]2)[cH:16][c:17]2[c:21]([c:22]([Cl:24])[cH:23]1)[C:20](=[O:25])[N:19]([CH2:26][c:27]1[cH:28][cH:29][c:30]([O:33][C:34]([F:35])([F:36])[F:37])[cH:31][cH:32]1)[CH2:18]2

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1140TolueneHCID 3283Diethyl EtherHCID 77384-Methoxybenzyl alcoholHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 117044755-Bromo-7-chloro-2-(4-trifluoromethoxybenzyl)-2,3-dihydroisoindol-1-one

Product 1

HCID 579494297-Chloro-5-(4-methoxy-benzyloxy)-2-(4-trifluoromethoxy-benzyl)-2,3-dihydro-isoindol-1-one

Sources & evidence

ORD record
ord-20d2901bcd0b41fb88ac94f15b5006da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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