Ethanol → 3-[[1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[CH2:11][N:12]1[C:13](=[O:38])[CH:14]([NH:23][CH:24]([CH2:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:15][CH2:16][c:17]2[c:18]1[cH:19][cH:20][cH:21][cH:22]2.[CH3:41][CH2:42][OH:43].[H:39][H:40]>>[O:8]=[C:9]([OH:10])[CH2:11][N:12]1[C:13](=[O:38])[CH:14]([NH:23][CH:24]([CH2:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:15][CH2:16][c:17]2[c:18]1[cH:19][cH:20][cH:21][cH:22]2Participants
4
Sources & evidence
- ORD record
- ord-724ccdf784f3438b808d056732dbe1d1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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