Ethanolamine → 5-[4-[2-(2-hydroxyethylamino)ethoxy]phenyl]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-2-ol
Reaction equation
[C:33](=[O:34])([OH:35])[O-:36].[CH3:38][OH:39].[I:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([C:11]2=[C:12]([c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:13][CH2:14][CH2:15][c:16]3[c:17]2[cH:18][cH:19][c:20]([OH:22])[cH:21]3)[cH:9][cH:10]1.[NH2:29][CH2:30][CH2:31][OH:32].[Na+:37]>>[CH2:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([C:11]2=[C:12]([c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:13][CH2:14][CH2:15][c:16]3[c:17]2[cH:18][cH:19][c:20]([OH:22])[cH:21]3)[cH:9][cH:10]1)[NH:29][CH2:30][CH2:31][OH:32]Participants
6
Sources & evidence
- ORD record
- ord-79814a30f17a4416be1d06887598411f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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