Carbonate Ion → Methyl 5-(butan-2-ylamino)-4-cyano-2-methylbenzoate
Reaction equation
[C:15](=[O:16])([O-:17])[O-:18].[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:14])[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][c:12]1[I:13].[CH2:26]1[O:27][CH2:28][CH2:29][O:30][CH2:31]1.[CH3:21][CH:22]([CH2:23][CH3:24])[NH2:25].[CH:34](=[CH:35][C:36]([CH:37]=[CH:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)=[O:45])[c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH:52](=[CH:53][C:54]([CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)=[O:63])[c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[CH:70](=[CH:71][C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)=[O:81])[c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1.[Cs+:19].[Cs+:20].[Pd:32].[Pd:33]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:14])[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][c:12]1[NH:25][CH:22]([CH3:21])[CH2:23][CH3:24]Participants
8
Sources & evidence
- ORD record
- ord-1399c6e265a045b392673507bcf42f99
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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