Hydrochloric Acid → HCID 21100168, compound

HRID 1147136Notes

Reaction equation

HRID 1147136 reaction equation
[CH3:19][C:20]([C:21](=[O:22])[c:23]1[cH:24][n:25][c:26]([N:28]2[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]2)[s:27]1)([CH3:34])[CH3:35].[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1.[ClH:18]>>[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([C:7](=[O:9])[N:31]2[CH2:30][CH2:29][N:28]([c:26]3[n:25][cH:24][c:23]([C:21]([C:20]([CH3:19])([CH3:34])[CH3:35])=[O:22])[s:27]3)[CH2:33][CH2:32]2)[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 21100207HCID 21100207, compoundHCID 211002372-Isopropoxy-5-methylsulfonylbenzoic acid

Product 1

HCID 21100168HCID 21100168, compound

Sources & evidence

ORD record
ord-5aede18f3df64fe0af9e1c6e23b53949
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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