4-Cyanobenzoic acid → HCID 178499705, compound
Reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11]1.[CH3:12][O:13][C:14]([CH:15]([NH:16][C:17]([CH:18]([NH:19][C:20]([c:21]1[cH:22][c:23]([NH2:27])[cH:24][cH:25][cH:26]1)=[O:28])[CH2:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[CH2:38][c:39]1[cH:40][cH:41][cH:42][c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]12)=[O:49]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:9])[NH:27][c:23]2[cH:22][c:21]([C:20]([NH:19][CH:18]([C:17]([NH:16][CH:15]([C:14]([O:13][CH3:12])=[O:49])[CH2:38][c:39]3[cH:40][cH:41][cH:42][c:43]4[cH:44][cH:45][cH:46][cH:47][c:48]34)=[O:37])[CH2:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:28])[cH:26][cH:25][cH:24]2)[cH:10][cH:11]1Participants
3
Sources & evidence
- ORD record
- ord-98d0be9ad91a424e9fbf7ae6f81c7706
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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