Citric Acid → tert-butyl 3-[4-[1-(5-cyano-1-benzofuran-2-yl)-3-ethoxy-3-oxoprop-1-en-2-yl]phenoxy]pyrrolidine-1-carboxylate
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([O:13][c:14]2[cH:15][cH:16][c:17]([C:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])=[O:26])[cH:18][cH:19]2)[CH2:11][CH2:12]1.[C:28](#[N:29])[c:30]1[cH:31][cH:32][c:33]2[c:34]([cH:35][c:36]([CH2:38][P+:39]([c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)([c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[c:52]3[cH:53][cH:54][cH:55][cH:56][cH:57]3)[o:37]2)[cH:58]1.[CH3:79][CH2:80][OH:81].[Cl-:27].[H-:59].[Na+:60].[O:74]1[CH2:75][CH2:76][CH2:77][CH2:78]1.[OH:61][C:62]([CH2:63][C:64]([C:65](=[O:66])[OH:67])([CH2:68][C:69](=[O:70])[OH:71])[OH:72])=[O:73]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([O:13][c:14]2[cH:15][cH:16][c:17]([C:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])=[CH:38][c:36]3[cH:35][c:34]4[c:33]([cH:32][cH:31][c:30]([C:28]#[N:29])[cH:58]4)[o:37]3)[cH:18][cH:19]2)[CH2:11][CH2:12]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-3c3daa84318e49729b2a7215e8f77837
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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