Acetic Acid → HCID 57639712, compound

HRID 1114201Notes

Reaction equation

HRID 1114201 reaction equation
[C:38]([OH:39])(=[O:40])[CH3:41].[CH3:36][OH:37].[Cl:27][c:28]1[cH:29][cH:30][c:31]([CH:32]=[O:33])[cH:34][cH:35]1.[NH2:1][c:2]1[cH:3][c:4](-[n:8]2[cH:9][n:10][c:11]3[c:12]2[cH:13][cH:14][c:15]([C:17](=[O:18])[NH:19][CH2:20][c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:16]3)[cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4](-[n:8]2[cH:9][n:10][c:11]3[c:12]2[cH:13][cH:14][c:15]([C:17](=[O:18])[NH:19][CH2:20][c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:16]3)[cH:5][cH:6][cH:7]1)[CH2:32][c:31]1[cH:30][cH:29][c:28]([Cl:27])[cH:35][cH:34]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 77264-ChlorobenzaldehydeHCID 69067477HCID 69067477, compound

Product 1

HCID 57639712HCID 57639712, compound

Sources & evidence

ORD record
ord-adaefbac08ba462ca5dfad8361175365
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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