Bicarbonate Ion → Methyl 2-[[2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethoxy]acetyl]amino]-5-bromobenzoate
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:17](=[O:18])[O:19][CH3:20])[c:5]([NH:8][C:9]([CH2:10][O:11][CH2:12][C:13](=[O:14])[OH:15])=[O:16])[cH:6][cH:7]1.[C:51](=[O:52])([O-:53])[OH:54].[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1.[Cl:26][C:27]([C:28]([Cl:29])=[O:30])=[O:31].[Na+:55].[O:21]=[CH:22][N:23]([CH3:24])[CH3:25]>>[Br:1][c:2]1[cH:3][c:4]([C:17](=[O:18])[O:19][CH3:20])[c:5]([NH:8][C:9]([CH2:10][O:11][CH2:12][C:13](=[O:15])[N:48]2[CH2:47][CH2:46][N:45]([CH:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:50][CH2:49]2)=[O:16])[cH:6][cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-eda051a443e34b9b86df80db41c8cf1e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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