Water → Methyl 1-(allyloxycarbonyl)-7-[4-(2-butoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate

HRID 109381

Reaction equation

HRID 109381 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:29]2)[CH:20]=[C:21]([C:25](=[O:26])[O:27][CH3:28])[CH2:22][CH2:23][NH:24]3)[cH:13][cH:14]1.[CH3:44][N:45]([CH3:46])[c:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1.[Cl:30][C:31](=[O:32])[O:33][CH2:34][CH:35]=[CH2:36].[OH2:37].[cH:38]1[cH:39][cH:40][n:41][cH:42][cH:43]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:29]2)[CH:20]=[C:21]([C:25](=[O:26])[O:27][CH3:28])[CH2:22][CH2:23][N:24]3[C:31](=[O:32])[O:33][CH2:34][CH:35]=[CH2:36])[cH:13][cH:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 1049PyridineHCID 142844-(Dimethylamino)pyridineHCID 18052Allyl chloroformateHCID 22328987methyl 7-[4-(2-butoxyethoxy)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylate

Product 1

HCID 22328895Methyl 1-(allyloxycarbonyl)-7-[4-(2-butoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate

Sources & evidence

ORD record
ord-c88c23ad5dc946ea8873480321ba103e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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