1,3-Benzenedicarboxylic acid, 5-(chlorosulfonyl)-, 1,3-dimethyl ester → HCID 86657434, compound
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10].[Cl:25][S:26](=[O:27])(=[O:28])[c:29]1[cH:30][c:31]([C:39](=[O:40])[O:41][CH3:42])[cH:32][c:33]([C:34](=[O:35])[O:36][CH3:37])[cH:38]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][N:19]([S:26](=[O:27])(=[O:28])[c:29]4[cH:30][c:31]([C:39](=[O:40])[O:41][CH3:42])[cH:32][c:33]([C:34](=[O:35])[O:36][CH3:37])[cH:38]4)[CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10]Participants
3
Sources & evidence
- ORD record
- ord-92529736435a4299978d28ce8989dcf1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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