Ketoprofen → HCID 70551308, compound
Reaction equation
[C:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)(=[O:13])[c:14]1[cH:15][c:16]([CH:20]([C:21](=[O:22])[OH:23])[CH3:24])[cH:17][cH:18][cH:19]1.[NH2:25][c:26]1[c:27]([Br:46])[cH:28][c:29]([C:30](=[O:31])[O:32][CH2:33][CH2:34][OH:35])[cH:36][c:37]1[CH2:38][N:39]1[CH2:40][CH2:41][N:42]([CH3:45])[CH2:43][CH2:44]1.[n-:1]1[cH:2][cH:3][n:4][cH:5]1>>[C:6]([c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)(=[O:13])[c:14]1[cH:15][c:16]([CH:20]([C:21]([O:22][CH2:34][CH2:33][O:32][C:30]([c:29]2[cH:28][c:27]([Br:46])[c:26]([NH2:25])[c:37]([CH2:38][N:39]3[CH2:40][CH2:41][N:42]([CH3:45])[CH2:43][CH2:44]3)[cH:36]2)=[O:31])=[O:23])[CH3:24])[cH:17][cH:18][cH:19]1Participants
4
Sources & evidence
- ORD record
- ord-00d102b3dc5641c999044c0ddf01fff2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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