Ethanol → 5-[{4-[(4-Butylphenyl)ethynyl]benzyl}(2-naphthoyl)amino]-2-hydroxybenzoic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([C:19](=[O:20])[c:21]3[cH:22][c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4[cH:29][cH:30]3)[c:31]3[cH:32][c:33]4[c:34]([cH:42][cH:43]3)[O:35][C:36]([CH3:40])([CH3:41])[O:37][C:38]4=[O:39])[cH:44][cH:45]2)[cH:9][cH:10]1.[CH3:48][CH2:49][OH:50].[Na+:47].[OH-:46]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([C:19](=[O:20])[c:21]3[cH:22][c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4[cH:29][cH:30]3)[c:31]3[cH:32][c:33]([C:38](=[O:37])[OH:39])[c:34]([OH:35])[cH:42][cH:43]3)[cH:44][cH:45]2)[cH:9][cH:10]1Participants
5
Sources & evidence
- ORD record
- ord-05ebbe475f6d43d5a0c15beec99e7a72
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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