Chloride → HCID 86741624, compound
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:18]=[CH:19][CH:20]=[CH:21][C:22](=[O:23])[N:24]2[CH2:25][CH2:26][N:27]([CH2:30][CH2:31][O:32][CH:33]([c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[CH2:28][CH2:29]2)[cH:6][c:7]([O:16][CH3:17])[c:8]1[O:9][CH2:10][O:11][CH2:12][CH2:13][O:14][CH3:15].[CH3:66][OH:67].[Cl-:59].[Na+:58].[Na+:60].[Na+:61].[O-:62][C:63](=[O:64])[O-:65].[OH2:46].[c:47]1([CH3:48])[cH:49][cH:50][c:51]([S:52]([OH:53])(=[O:54])=[O:55])[cH:56][cH:57]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:18]=[CH:19][CH:20]=[CH:21][C:22](=[O:23])[N:24]2[CH2:25][CH2:26][N:27]([CH2:30][CH2:31][O:32][CH:33]([c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[CH2:28][CH2:29]2)[cH:6][c:7]([O:16][CH3:17])[c:8]1[OH:9]Participants
8
Sources & evidence
- ORD record
- ord-f09e602b15844a84ac3ce540e8b34efb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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