Chloride → Ethyl 6-[(4,4-dimethylchroman-6-yl)ethynyl]nicotinate
Reaction equation
[CH3:1][C:2]1([CH3:14])[CH2:3][CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]([C:12]#[CH:13])[cH:10][c:11]21.[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[Cl-:38].[Cl-:40].[Cl:15][c:16]1[n:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:25][cH:26]1.[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[Zn+2:39]>>[CH3:1][C:2]1([CH3:14])[CH2:3][CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]([C:12]#[C:13][c:16]3[n:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:25][cH:26]3)[cH:10][c:11]21Participants
7
Sources & evidence
- ORD record
- ord-ec40a199ccb247fb8d825b65f73767cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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