Acetate → methyl N-[2-chloro-5-(1-hydroxyiminoethyl)benzyl]carbamate

HRID 1141043Notes

Reaction equation

HRID 1141043 reaction equation
[C:42]([O:43][CH2:44][CH3:45])(=[O:46])[CH3:47].[CH3:20][C:21](=[O:22])[O-:23].[CH:24]([CH3:25])=[N:26][OH:27].[ClH:28].[Cu+2:34].[N:15]([O-:16])=[O:17].[NH2:1][c:2]1[cH:3][cH:4][c:5]([Cl:14])[c:6]([CH2:7][NH:8][C:9]([O:10][CH3:11])=[O:12])[cH:13]1.[Na+:18].[Na+:19].[OH2:48].[S:29]([O-:30])([O-:31])(=[O:32])=[O:33].[c:35]1([CH3:36])[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[c:2]1([C:24]([CH3:25])=[N:26][OH:27])[cH:3][cH:4][c:5]([Cl:14])[c:6]([CH2:7][NH:8][C:9]([O:10][CH3:11])=[O:12])[cH:13]1

Participants

12

Reactant 11

HCID 175AcetateHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 946NitriteHCID 962WaterHCID 1117Sulfate IonHCID 1140TolueneHCID 7863AldoximeHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 12151321HCID 12151321, compound

Product 1

HCID 86641517methyl N-[2-chloro-5-(1-hydroxyiminoethyl)benzyl]carbamate

Sources & evidence

ORD record
ord-b1ca9d217ee14981b30428ced2d34d06
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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