Dichloromethane → 4-[2-(4,4-Dimethyl-chroman-7-yl)-heptanoyloxy]-benzoic acid benzyl ester
Reaction equation
[CH3:1][C:2]1([CH3:21])[CH2:3][CH2:4][O:5][c:6]2[cH:7][c:8]([CH:12]([C:13](=[O:14])[OH:15])[CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[cH:9][cH:10][c:11]21.[CH3:57][N:58]([c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1)[CH3:65].[CH:39]1([N:40]=[C:41]=[N:42][CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]1.[Cl:54][CH2:55][Cl:56].[OH:22][c:23]1[cH:24][cH:25][c:26]([C:27](=[O:28])[O:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:37][cH:38]1>>[CH3:1][C:2]1([CH3:21])[CH2:3][CH2:4][O:5][c:6]2[cH:7][c:8]([CH:12]([C:13]([O:14][c:23]3[cH:24][cH:25][c:26]([C:27](=[O:28])[O:29][CH2:30][c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[cH:37][cH:38]3)=[O:15])[CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[cH:9][cH:10][c:11]21Participants
6
Sources & evidence
- ORD record
- ord-109e2e287045460c8d93000fe7818e96
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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