Isopropanol → HCID 77195608, compound
Reaction equation
[CH:49]([OH:50])([CH3:51])[CH3:52].[Cl:53][CH2:54][Cl:55].[N+:37](=[O:38])([O-:39])[c:40]1[cH:41][c:42]([N:46]=[C:47]=[O:48])[cH:43][cH:44][cH:45]1.[NH2:1][c:2]1[cH:3][c:4]([CH2:8][O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][N:19]2[C:20](=[O:36])[O:21][CH:22]([c:24]3[cH:25][c:26]4[c:27]([cH:34][cH:35]3)[O:28][C:29]([CH3:32])([CH3:33])[O:30][CH2:31]4)[CH2:23]2)[cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4]([CH2:8][O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][N:19]2[C:20](=[O:36])[O:21][CH:22]([c:24]3[cH:25][c:26]4[c:27]([cH:34][cH:35]3)[O:28][C:29]([CH3:32])([CH3:33])[O:30][CH2:31]4)[CH2:23]2)[cH:5][cH:6][cH:7]1)[C:47]([NH:46][c:42]1[cH:41][c:40]([N+:37](=[O:38])[O-:39])[cH:45][cH:44][cH:43]1)=[O:48]Participants
5
Sources & evidence
- ORD record
- ord-d9f03855b872414c9f0b1795f30ec286
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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