Ammonium → 6-[4-({[3-(2,6-Dichlorophenyl)-5-(1-methylethyl)-4-isoxazolyl]methyl}oxy)phenyl]-1-naphthalenecarbonitrile
Reaction equation
[C:53](=[O:54])([O-:55])[OH:56].[CH2:58]([Cl:59])[Cl:60].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:1][c:2]1[c:3](-[c:9]2[n:10][o:11][c:12]([CH:35]([CH3:36])[CH3:37])[c:13]2[CH2:14][O:15][c:16]2[cH:17][cH:18][c:19](-[c:22]3[cH:23][c:24]4[cH:25][cH:26][cH:27][c:28]([C:32](=[O:33])[NH2:34])[c:29]4[cH:30][cH:31]3)[cH:20][cH:21]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[NH4+:57].[O:45]([Cl:46])[Cl:47].[P:48]([Cl:49])([Cl:50])([Cl:51])=[O:52]>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10][o:11][c:12]([CH:35]([CH3:36])[CH3:37])[c:13]2[CH2:14][O:15][c:16]2[cH:17][cH:18][c:19](-[c:22]3[cH:23][c:24]4[cH:25][cH:26][cH:27][c:28]([C:32]#[N:34])[c:29]4[cH:30][cH:31]3)[cH:20][cH:21]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-6e4fb312aac1476ba828013f22c440a6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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