Acetate → 1,1-Dimethylethyl 7-({2-(methyloxy)-4-[(methyloxy)carbonyl]phenyl}oxy)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

HRID 318843

Reaction equation

HRID 318843 reaction equation
[C:45]([O-:46])(=[O:47])[CH3:48].[C:50]([O-:51])(=[O:52])[CH3:53].[CH3:1][C:2]([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][cH:16][c:17]([B:19]([OH:20])[OH:21])[cH:18]2)[CH2:13][CH2:14]1.[CH3:22][O:23][C:24](=[O:25])[c:26]1[cH:27][cH:28][c:29]([OH:30])[c:31]([O:32][CH3:33])[cH:34]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[Cl:42][CH2:43][Cl:44].[Cu+2:49]>>[CH3:1][C:2]([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][cH:16][c:17]([O:30][c:29]3[cH:28][cH:27][c:26]([C:24]([O:23][CH3:22])=[O:25])[cH:34][c:31]3[O:32][CH3:33])[cH:18]2)[CH2:13][CH2:14]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 19844Methyl VanillateHCID 27099Cupric cationHCID 57440296(3-(tert-Butoxycarbonyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)boronic acid

Product 1

HCID 574402971,1-Dimethylethyl 7-({2-(methyloxy)-4-[(methyloxy)carbonyl]phenyl}oxy)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

Sources & evidence

ORD record
ord-a1e9c44a865148f8a29a48869717f5af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

Loading…