Benzene → HCID 13466235, compound
Reaction equation
[CH3:24][C:25](=[O:26])[O:27][C:28](=[O:29])[CH3:30].[c:1]1([C:11]2([OH:17])[CH2:12][CH2:13][NH:14][CH2:15][CH2:16]2)[n:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12.[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[c:1]1([C:11]2([OH:17])[CH2:12][CH2:13][N:14]([C:25]([CH3:24])=[O:26])[CH2:15][CH2:16]2)[n:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12Participants
5
Sources & evidence
- ORD record
- ord-7d105d7061ae4522996c35c1c78d00db
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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