3-Chlorobenzoic Acid → HCID 66703975, compound
Reaction equation
[Cl:27][c:28]1[cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35][cH:36]1.[NH2:1][CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]([CH3:26])[CH2:7][CH:8]2[CH2:9][N:10]1[C:11](=[O:12])[c:13]1[n:14][c:15]([CH3:25])[s:16][c:17]1-[c:18]1[cH:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1>>[NH:1]([CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]([CH3:26])[CH2:7][CH:8]2[CH2:9][N:10]1[C:11](=[O:12])[c:13]1[n:14][c:15]([CH3:25])[s:16][c:17]1-[c:18]1[cH:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1)[C:31]([c:30]1[cH:29][c:28]([Cl:27])[cH:36][cH:35][cH:34]1)=[O:32]Participants
3
Sources & evidence
- ORD record
- ord-4ca1f1c147174236bbd4120e048c26c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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