Acetic Acid → Methyl {4-[({3-[3-benzoyl-8-(trifluoromethyl)quinolin-4-yl]phenyl}amino)methyl]phenyl}acetate
Reaction equation
[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:30][O:31][C:32]([CH2:33][c:34]1[cH:35][cH:36][c:37]([CH:40]=[O:41])[cH:38][cH:39]1)=[O:42].[CH3:43][C:44](=[O:45])[OH:46].[NH2:1][c:2]1[cH:3][c:4](-[c:8]2[c:9]([C:22](=[O:23])[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:10][n:11][c:12]3[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][c:17]23)[cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4](-[c:8]2[c:9]([C:22](=[O:23])[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:10][n:11][c:12]3[c:13]([C:18]([F:19])([F:20])[F:21])[cH:14][cH:15][cH:16][c:17]23)[cH:5][cH:6][cH:7]1)[CH2:40][c:37]1[cH:36][cH:35][c:34]([CH2:33][C:32]([O:31][CH3:30])=[O:42])[cH:39][cH:38]1Participants
5
Sources & evidence
- ORD record
- ord-26c966584c5b4493a56ff6d4c89fac89
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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