Benzene → HCID 12912435, compound
Reaction equation
[CH3:24][C:25]([Cl:26])=[O:27].[ClH:28].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([CH3:17])[c:9]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[c:10]1[CH3:11].[OH2:35].[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1.[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[NH:1]([c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([CH3:17])[c:9]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[c:10]1[CH3:11])[C:25]([CH3:24])=[O:27]Participants
7
Sources & evidence
- ORD record
- ord-2b59936f72ee42b4a44c1a789c044d81
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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