Acetic Acid → HCID 57541251, compound

HRID 114523Notes

Reaction equation

HRID 114523 reaction equation
[C:29](=[O:30])([O-:31])[OH:32].[C:34]([OH:35])(=[O:36])[CH3:37].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[cH:8][cH:9][c:10]1[c:11]([c:12]2=[O:13])[cH:14][c:15]([CH:18]([C:19]([O:20][CH3:21])=[O:22])[S:23](=[O:24])(=[O:25])[N:26]([CH3:27])[CH3:28])[cH:16][cH:17]1.[ClH:38].[Na+:33]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[cH:8][cH:9][c:10]1[c:11]([c:12]2=[O:13])[cH:14][c:15]([CH2:18][S:23](=[O:24])(=[O:25])[N:26]([CH3:27])[CH3:28])[cH:16][cH:17]1

Participants

6

Sources & evidence

ORD record
ord-d21ae75bef0042a9aec986981c38da00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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