ethyl 4-[2-(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)ethenyl]benzoate → 4-[2-(5,5-dimethyl-8-phenylsulfanyl-6H-naphthalen-2-yl)ethenyl]benzoic acid
Reaction equation
[CH2:31]([CH3:32])[O:33][C:34]([c:35]1[cH:36][cH:37][c:38]([CH:41]=[CH:42][c:43]2[cH:44][c:45]3[c:50]([cH:51][cH:52]2)[C:49]([CH3:53])([CH3:54])[CH2:48][CH:47]=[C:46]3[S:55][c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[cH:39][cH:40]1)=[O:62].[CH3:1][C:2]1([CH3:3])[CH2:4][CH:5]=[C:6]([c:7]2[s:8][cH:9][cH:10][cH:11]2)[c:12]2[cH:13][c:14]([CH:15]=[CH:16][c:17]3[cH:18][cH:19][c:20]([C:21]([O:22][CH2:23][CH3:24])=[O:25])[cH:26][cH:27]3)[cH:28][cH:29][c:30]21>>[O:33]=[C:34]([c:35]1[cH:36][cH:37][c:38]([CH:41]=[CH:42][c:43]2[cH:44][c:45]3[c:50]([cH:51][cH:52]2)[C:49]([CH3:53])([CH3:54])[CH2:48][CH:47]=[C:46]3[S:55][c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[cH:39][cH:40]1)[OH:62]Participants
3
Sources & evidence
- ORD record
- ord-148fedb2aef24f84ab0f0fef7daf0157
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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