Ethanol → 1,1-dimethylethyl 7-hydroxy-8-iodo-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][c:16]([OH:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1.[CH3:23][NH2:24].[CH3:25][CH2:26][OH:27].[I-:21].[I:22].[Na+:20].[OH2:28]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][c:16]([OH:19])[c:17]([I:21])[cH:18]2)[CH2:13][CH2:14]1Participants
8
Sources & evidence
- ORD record
- ord-109710bd1c1f4f2581593852d5201a9e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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