6-Bromo-2-(4-methanesulfonylbenzyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acid → HCID 69157753, compound

HRID 146424Notes

Reaction equation

HRID 146424 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:6]([C:24](=[O:25])[OH:26])[n:7]([CH2:13][c:14]3[cH:15][cH:16][c:17]([S:20](=[O:21])(=[O:22])[CH3:23])[cH:18][cH:19]3)[c:8](=[O:12])[c:9]2[cH:10][cH:11]1.[CH3:33][O:34][C:35](=[O:36])[c:37]1[n:38][cH:39][cH:40][c:41]([CH2:43][OH:44])[cH:42]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:6]([C:24]([O:25][CH2:43][c:41]3[cH:40][cH:39][n:38][c:37]([C:35]([O:34][CH3:33])=[O:36])[cH:42]3)=[O:26])[n:7]([CH2:13][c:14]3[cH:15][cH:16][c:17]([S:20](=[O:21])(=[O:22])[CH3:23])[cH:18][cH:19]3)[c:8](=[O:12])[c:9]2[cH:10][cH:11]1

Participants

3

Reactant 2

HCID 230609586-Bromo-2-(4-methanesulfonylbenzyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acidHCID 23093785Methyl 4-(hydroxymethyl)pyridine-2-carboxylate

Product 1

HCID 69157753HCID 69157753, compound

Sources & evidence

ORD record
ord-f6f16e84c8a447688dcbdf53cf491d68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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