Acetic Acid → 2-(9-(1-(4-chlorophenyl)ethyl)-6-fluoro-8-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetic acid
Reaction equation
[C:69]([OH:70])(=[O:71])[CH3:72].[CH2:1]([CH3:2])[CH:3]([C:4](=[O:5])[O-:6])[CH:7]1[CH2:8][CH2:9][CH2:10][c:11]2[c:12]3[cH:13][c:14]([F:33])[cH:15][c:16]([S:29](=[O:30])(=[O:31])[CH3:32])[c:17]3[n:18]([CH:20]([CH3:21])[c:22]3[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]3)[c:19]21.[CH2:34]([CH:35]([CH:36]1[c:37]2[n:38]([CH:39]([c:40]3[cH:41][cH:42][c:43]([Cl:44])[cH:45][cH:46]3)[CH3:47])[c:48]3[c:49]([cH:50][c:51]([F:52])[cH:53][c:54]3[S:55]([CH3:56])(=[O:57])=[O:58])[c:59]2[CH2:60][CH2:61][CH2:62]1)[C:63]([O-:64])=[O:65])[CH3:66].[CH2:73]1[O:74][CH2:75][CH2:76][CH2:77]1.[CH3:78][OH:79].[Li+:68].[OH-:67]>>[CH2:3]([C:4](=[O:5])[OH:6])[CH:7]1[CH2:8][CH2:9][CH2:10][c:11]2[c:12]3[cH:13][c:14]([F:33])[cH:15][c:16]([S:29](=[O:30])(=[O:31])[CH3:32])[c:17]3[n:18]([CH:20]([CH3:21])[c:22]3[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]3)[c:19]21Participants
7
Sources & evidence
- ORD record
- ord-d48d544c733e4635886af1c7fc8e7de5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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