4-Nitrobenzoic Acid → HCID 67373351, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([OH:25])[CH:11]([NH:14][C:15](=[O:16])[O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:12][CH2:13]1.[CH2:71]1[O:72][CH2:73][CH2:74][CH2:75]1.[N+:45](=[O:46])([O-:47])[c:48]1[cH:49][cH:50][c:51]([C:52](=[O:53])[OH:54])[cH:55][cH:56]1.[O:57]=[C:58]([O:59][CH:60]([CH3:61])[CH3:62])[N:63]=[N:64][C:65]([O:66][CH:67]([CH3:68])[CH3:69])=[O:70].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([O:25][C:52]([c:51]2[cH:50][cH:49][c:48]([N+:45](=[O:46])[O-:47])[cH:56][cH:55]2)=[O:53])[CH:11]([NH:14][C:15](=[O:16])[O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-24aac83a1c5e433c88c386e6ca4c7d6d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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