Benzoate → [4-(1-Fluorodecan-2-yloxycarbonyl)phenyl] 4-(4-octylphenyl)benzoate
Reaction equation
[CH2:39]([CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46])[c:47]1[cH:48][cH:49][c:50](-[c:53]2[cH:54][cH:55][c:56]([C:59](=[O:60])[OH:61])[cH:57][cH:58]2)[cH:51][cH:52]1.[CH2:62]([Cl:63])[Cl:64].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl-:38].[O-:1][C:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)=[O:9].[OH:10][c:11]1[cH:12][cH:13][c:14]([C:15](=[O:16])[O:17][CH:18]([CH2:19][F:20])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[cH:29][cH:30]1>>[O:10]([c:11]1[cH:12][cH:13][c:14]([C:15](=[O:16])[O:17][CH:18]([CH2:19][F:20])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[cH:29][cH:30]1)[C:59]([c:56]1[cH:55][cH:54][c:53](-[c:50]2[cH:49][cH:48][c:47]([CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46])[cH:52][cH:51]2)[cH:58][cH:57]1)=[O:60]Participants
7
Sources & evidence
- ORD record
- ord-7693c91553f24998b01ab9c81b0d68dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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