Acetic Acid → HCID 18403521, compound

HRID 161331Notes

Reaction equation

HRID 161331 reaction equation
[C:28]([OH:29])(=[O:30])[CH3:31].[CH3:1][n:2]1[cH:3][c:4]([C:12]2=[C:16]([c:17]3[cH:18][c:19]([N+:23]([O-:24])=[O:25])[cH:20][cH:21][cH:22]3)[C:15](=[O:26])[NH:14][C:13]2=[O:27])[c:5]2[cH:6][c:7]([Cl:11])[cH:8][cH:9][c:10]12>>[CH3:1][n:2]1[cH:3][c:4]([C:12]2=[C:16]([c:17]3[cH:18][c:19]([NH2:23])[cH:20][cH:21][cH:22]3)[C:15](=[O:26])[NH:14][C:13]2=[O:27])[c:5]2[cH:6][c:7]([Cl:11])[cH:8][cH:9][c:10]12

Participants

3

Reactant 2

HCID 176Acetic AcidHCID 18403494HCID 18403494, compound

Product 1

HCID 18403521HCID 18403521, compound

Sources & evidence

ORD record
ord-bdbaa12ab8924ce79b0f362b5dcbf52a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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