Toluene → 2-[(Benzyloxycarbonyl)(methyl)amino]-6-chloro-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acid pyridin-4-ylmethyl ester
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([n:12]1[c:13](=[O:32])[c:14]2[cH:15][cH:16][c:17]([Cl:31])[cH:18][c:19]2[c:20](-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:21]1[C:22](=[O:23])[OH:24])[CH3:33].[CH2:80]1[O:81][CH2:82][CH2:83][CH2:84]1.[N:68]([C:69]([O:70][CH2:71][CH3:72])=[O:73])=[N:74][C:75]([O:76][CH2:77][CH3:78])=[O:79].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:61]1([CH3:62])[cH:63][cH:64][cH:65][cH:66][cH:67]1.[n:53]1[cH:54][cH:55][c:56]([CH2:59][OH:60])[cH:57][cH:58]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([n:12]1[c:13](=[O:32])[c:14]2[cH:15][cH:16][c:17]([Cl:31])[cH:18][c:19]2[c:20](-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:21]1[C:22]([O:23][CH2:59][c:56]1[cH:55][cH:54][n:53][cH:58][cH:57]1)=[O:24])[CH3:33]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-89199a971a4443c4896627a9ac87e8c9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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