Isopropanol → HCID 67521544, compound
Reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][n:15]1[cH:16][cH:17][c:18]2[n:19][cH:20][n:21][c:22]([Cl:24])[c:23]12.[CH:47]([OH:48])([CH3:49])[CH3:50].[NH2:25][c:26]1[cH:27][c:28]([Cl:46])[c:29]([O:30][c:31]2[cH:32][cH:33][c:34]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[cH:42][cH:43]2)[cH:44][cH:45]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][n:15]1[cH:16][cH:17][c:18]2[n:19][cH:20][n:21][c:22]([NH:25][c:26]3[cH:27][c:28]([Cl:46])[c:29]([O:30][c:31]4[cH:32][cH:33][c:34]([C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[cH:42][cH:43]4)[cH:44][cH:45]3)[c:23]12Participants
4
Sources & evidence
- ORD record
- ord-926ffe40f1204d2d9babf82192a551fd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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