Benzoate → HCID 22411508, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:18](=[O:19])[O:20][CH3:21])[CH2:10][CH:11]([O:13][S:14]([CH3:15])(=[O:16])=[O:17])[CH2:12]1.[C:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)(=[O:29])[O-:30].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[CH3:38][S:39](=[O:40])[CH3:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Na+:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:18](=[O:19])[O:20][CH3:21])[CH2:10][CH:11]([O:13][C:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)=[O:29])[CH2:12]1Participants
7
Sources & evidence
- ORD record
- ord-7957f36bb7374d469b226fbe87354feb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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