Chloride → HCID 69137736, compound

HRID 184443Notes

Reaction equation

HRID 184443 reaction equation
[Br:18][c:19]1[c:20]2[cH:21][cH:22][c:23]([CH2:42][NH3+:43])[cH:24][c:25]2[cH:26][cH:27][c:28]1[O:29][CH:30]([CH2:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[C:38](=[O:39])[O:40][CH3:41].[CH2:52]([Cl:53])[Cl:54].[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cl-:44].[Cl:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]([C:11](=[O:12])[Cl:13])[o:10]2)[cH:14][c:15]([Cl:17])[cH:16]1>>[Cl:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]([C:11](=[O:12])[NH:43][CH2:42][c:23]3[cH:22][cH:21][c:20]4[c:19]([Br:18])[c:28]([O:29][CH:30]([CH2:31][c:32]5[cH:33][cH:34][cH:35][cH:36][cH:37]5)[C:38](=[O:39])[O:40][CH3:41])[cH:27][cH:26][c:25]4[cH:24]3)[o:10]2)[cH:14][c:15]([Cl:17])[cH:16]1

Participants

6

Sources & evidence

ORD record
ord-00a8b2d65e574a0085ceb4dccf0e4ea5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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