Isopropanol → 1-[N-benzyl-[2-(3-carbamoyl-4-hydroxyphenoxy)-ethylamino]]-3-[2-(indol-2-yl)-phenoxy]-2-propanol
Reaction equation
[CH2:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[NH:28][CH2:29][CH2:30][O:31][c:32]1[cH:33][cH:34][c:35]([OH:41])[c:36]([C:37](=[O:38])[NH2:39])[cH:40]1.[CH:42]([OH:43])([CH3:44])[CH3:45].[O:1]1[CH:2]([CH2:3][O:4][c:5]2[c:6](-[c:11]3[nH:12][c:13]4[cH:14][cH:15][cH:16][cH:17][c:18]4[cH:19]3)[cH:7][cH:8][cH:9][cH:10]2)[CH2:20]1>>[OH:1][CH:2]([CH2:3][O:4][c:5]1[c:6](-[c:11]2[nH:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]3[cH:19]2)[cH:7][cH:8][cH:9][cH:10]1)[CH2:20][N:28]([CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[CH2:29][CH2:30][O:31][c:32]1[cH:33][cH:34][c:35]([OH:41])[c:36]([C:37](=[O:38])[NH2:39])[cH:40]1Participants
4
Sources & evidence
- ORD record
- ord-5c7cce88b22d47d2af08fe1c4b5b4850
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…