Benzoic Acid → HCID 18186449, compound
Reaction equation
[NH2:1][c:2]1[c:3]([NH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][CH:17]([CH2:18][N:19]([CH3:20])[CH3:21])[OH:22])[cH:13][cH:14]2)[n:6][cH:7]1.[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH:30][C:31](=[O:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[NH:1]([c:2]1[c:3]([NH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][CH:17]([CH2:18][N:19]([CH3:20])[CH3:21])[OH:22])[cH:13][cH:14]2)[n:6][cH:7]1)[C:31](=[O:30])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1Participants
4
Sources & evidence
- ORD record
- ord-64e4525497f44cf29b75793e9664511b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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