Benzoic Acid → HCID 178459368, compound
Reaction equation
[OH:1][c:2]1[c:3]([C:20](=[O:21])[NH:22][c:23]2[s:24][cH:25][cH:26][n:27]2)[c:4]([CH:16]([CH2:17][CH3:18])[OH:19])[n:5][c:6]2[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][cH:10][c:11]12.[OH:28][C:29](=[O:30])[c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[OH:1][c:2]1[c:3]([C:20](=[O:21])[NH:22][c:23]2[s:24][cH:25][cH:26][n:27]2)[c:4]([CH:16]([CH2:17][CH3:18])[O:19][C:29](=[O:28])[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[n:5][c:6]2[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][cH:10][c:11]12Participants
3
Sources & evidence
- ORD record
- ord-1b53b70660854c4daffb094c0a5825e7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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