Tetrahydrofuran → 3-[[4-(4-Acetyl-2-chloro-3-hydroxy-phenoxymethyl)-phenyl]-(tetrahydro-pyran-2-yloxy)-methyl]-benzonitrile

HRID 110320

Reaction equation

HRID 110320 reaction equation
[Cl:1][c:2]1[c:3]([OH:12])[c:4]([C:9]([CH3:10])=[O:11])[cH:5][cH:6][c:7]1[OH:8].[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1.[OH:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([CH:21]([c:22]2[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29]2)[O:30][CH:31]2[O:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[cH:19][cH:20]1.[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[Cl:1][c:2]1[c:3]([OH:12])[c:4]([C:9]([CH3:10])=[O:11])[cH:5][cH:6][c:7]1[O:8][CH2:14][c:15]1[cH:16][cH:17][c:18]([CH:21]([c:22]2[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29]2)[O:30][CH:31]2[O:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[cH:19][cH:20]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 574382941-(3-Chloro-2,4-dihydroxy-phenyl)ethanoneHCID 574382993-[(4-Hydroxymethyl-phenyl)-(tetrahydro-pyran-2-yloxy)-methyl]-benzonitrile

Product 1

HCID 578844993-[[4-(4-Acetyl-2-chloro-3-hydroxy-phenoxymethyl)-phenyl]-(tetrahydro-pyran-2-yloxy)-methyl]-benzonitrile

Sources & evidence

ORD record
ord-1e4668f9783f4b3ba02c6169dc622b86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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