Benzoic Acid → HCID 178429303, compound
Reaction equation
[C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)(=[O:30])[OH:31].[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[Cl-:22].[Cl:37][CH2:38][Cl:39].[NH2:1][c:2]1[nH:3][c:4]2[c:5]([cH:6][c:7]3[c:11]([cH:12]2)[N:10]([CH2:13][CH2:14][CH:15]2[CH2:16][CH2:17]2)[C:9](=[O:18])[C:8]3([CH3:19])[CH3:20])[n:21]1>>[NH:1]([c:2]1[nH:3][c:4]2[c:5]([cH:6][c:7]3[c:11]([cH:12]2)[N:10]([CH2:13][CH2:14][CH:15]2[CH2:16][CH2:17]2)[C:9](=[O:18])[C:8]3([CH3:19])[CH3:20])[n:21]1)[C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30]Participants
6
Sources & evidence
- ORD record
- ord-659d22a7df9a4d98bca2f5f3e7e880ce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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