Acetic Acid → [4-(5-(Cyclopropyl-amino)-8,8-dimethyl-5,6,7,8-tetrahydro-naphthalene-2-yl-ethynyl)-2-fluoro-phenyl] acetic acid ethyl ester
Reaction equation
[C:36]([BH3-:37])#[N:38].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[c:7]([F:27])[cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]3[c:21]([cH:22][cH:23]2)[C:20](=[O:24])[CH2:19][CH2:18][C:17]3([CH3:25])[CH3:26])[cH:10][cH:11]1)=[O:28].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH3:52][C:53](=[O:54])[OH:55].[CH3:56][C:57]#[N:58].[CH:32]1([NH2:35])[CH2:33][CH2:34]1.[Cl:29][CH2:30][Cl:31].[Na+:39]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[c:7]([F:27])[cH:8][c:9]([C:12]#[C:13][c:14]2[cH:15][c:16]3[c:21]([cH:22][cH:23]2)[CH:20]([NH:35][CH:32]2[CH2:33][CH2:34]2)[CH2:19][CH2:18][C:17]3([CH3:25])[CH3:26])[cH:10][cH:11]1)=[O:28]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-1f53cee2b2674d42bacdf6114b8ddf63
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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