Hydrochloric Acid → [4-(3-Cyclopentyloxy-5-phenylethynyl-phenylsulfanyl)-2-methyl-phenoxy]-acetic Acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:34])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)[cH:17][c:18]([C:20]#[C:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[cH:19]2)[cH:11][cH:12]1)=[O:35].[CH3:39][CH2:40][OH:41].[ClH:38].[Na+:37].[OH-:36]>>[O:3]=[C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:34])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)[cH:17][c:18]([C:20]#[C:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[cH:19]2)[cH:11][cH:12]1)[OH:35]Participants
6
Sources & evidence
- ORD record
- ord-9345b8572df148a2807f8a1d79c8c683
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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