Ethanol → Ethyl 4'-(3-propylaminopropoxy)-3'-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphth-2-yl)biphenyl-4-carboxylate
Reaction equation
[CH2:1]([CH2:2][CH3:3])[NH2:4].[CH3:41][CH2:42][OH:43].[I:5][CH2:6][CH2:7][CH2:8][O:9][c:10]1[c:11](-[c:27]2[cH:28][c:29]3[c:34]([cH:35][cH:36]2)[C:33]([CH3:37])([CH3:38])[CH2:32][CH2:31][C:30]3([CH3:39])[CH3:40])[cH:12][c:13](-[c:16]2[cH:17][cH:18][c:19]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:20][cH:21]2)[cH:14][cH:15]1>>[CH2:1]([CH2:2][CH3:3])[NH:4][CH2:6][CH2:7][CH2:8][O:9][c:10]1[c:11](-[c:27]2[cH:28][c:29]3[c:34]([cH:35][cH:36]2)[C:33]([CH3:37])([CH3:38])[CH2:32][CH2:31][C:30]3([CH3:39])[CH3:40])[cH:12][c:13](-[c:16]2[cH:17][cH:18][c:19]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:20][cH:21]2)[cH:14][cH:15]1Participants
4
Sources & evidence
- ORD record
- ord-dcf01cb21aa345c7b16b3edbbbc92453
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)