Acetic Acid → HCID 66769367, compound

HRID 2318202Notes

Reaction equation

HRID 2318202 reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][CH2:40][OH:41].[Cl:1][c:2]1[cH:3][c:4]([NH:8][CH:9]2[CH2:10][N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]2)[n:5][cH:6][n:7]1.[O:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[c:28]1[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]1>>[c:2]1([NH:32][c:31]2[cH:30][cH:29][c:28]([O:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[cH:34][cH:33]2)[cH:3][c:4]([NH:8][CH:9]2[CH2:10][N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]2)[n:5][cH:6][n:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 8764(4-Aminophenoxy)benzeneHCID 22309469HCID 22309469, compound

Product 1

HCID 66769367HCID 66769367, compound

Sources & evidence

ORD record
ord-197aec4fc06b4eb28bb5b9afc82fd8c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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