3-(Aminosulfonyl)-5-nitro-4-phenoxybenzoic acid → Benzoic acid,3-amino-5-(aminosulfonyl)-4-[3-(trifluoromethyl)phenoxy]-
Reaction equation
[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:24]([NH2:25])(=[O:26])=[O:27])[c:12]1[O:13][c:14]1[cH:15][c:16]([C:20]([F:21])([F:22])[F:23])[cH:17][cH:18][cH:19]1.[N+:28]([c:29]1[cH:30][c:31]([C:46]([OH:47])=[O:48])[cH:32][c:33]([S:34](=[O:35])(=[O:36])[NH2:37])[c:38]1[O:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)([O-:49])=[O:50]>>[NH2:1][c:4]1[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:24]([NH2:25])(=[O:26])=[O:27])[c:12]1[O:13][c:14]1[cH:15][c:16]([C:20]([F:21])([F:22])[F:23])[cH:17][cH:18][cH:19]1Participants
3
Sources & evidence
- ORD record
- ord-c71a8274686d40309184157dc3b6e083
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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