2-Isopropoxy-5-methylsulfonylbenzoic acid → HCID 58677882, compound

HRID 2321870Notes

Reaction equation

HRID 2321870 reaction equation
[CH:20]([CH3:21])([CH3:22])[O:23][c:24]1[c:25]([C:26](=[O:27])[OH:28])[cH:29][c:30]([S:33](=[O:34])(=[O:35])[CH3:36])[cH:31][cH:32]1.[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10]3[c:15]([cH:16][cH:17]2)[CH2:14][NH:13][CH2:12][CH2:11]3)[cH:18][cH:19]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10]3[c:15]([cH:16][cH:17]2)[CH2:14][N:13]([C:26]([c:25]2[c:24]([O:23][CH:20]([CH3:21])[CH3:22])[cH:32][cH:31][c:30]([S:33](=[O:34])(=[O:35])[CH3:36])[cH:29]2)=[O:27])[CH2:12][CH2:11]3)[cH:18][cH:19]1

Participants

3

Reactant 2

HCID 211002372-Isopropoxy-5-methylsulfonylbenzoic acidHCID 22641899HCID 22641899, compound

Product 1

HCID 58677882HCID 58677882, compound

Sources & evidence

ORD record
ord-e20c3763121c4bdd904929f0144542cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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