2,5-Dichlorobenzoic acid → HCID 21110283, compound
Reaction equation
[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([Cl:11])[cH:9][cH:10]1.[NH2:12][c:13]1[cH:14][c:15]2[c:20]([cH:21][cH:22]1)[C:19](=[O:23])[CH2:18][CH2:17][CH2:16]2.[S:31]([Cl:32])([Cl:33])=[O:34]>>[Cl:1][c:2]1[c:3]([C:4](=[O:6])[NH:12][c:13]2[cH:14][c:15]3[c:20]([cH:21][cH:22]2)[C:19](=[O:23])[CH2:18][CH2:17][CH2:16]3)[cH:7][c:8]([Cl:11])[cH:9][cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-3ec04b1aafdd4be1a6e7ac827b5bfdae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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