Benzene → HCID 13132061, compound

HRID 1143132Notes

Reaction equation

HRID 1143132 reaction equation
[C:17]([CH3:18])(=[O:19])[S:20][CH:21]1[CH2:22][C:23](=[O:25])[NH:24]1.[C:2]([CH:3]=[O:4])(=[O:5])[O:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([N+:14](=[O:15])[O-:16])[cH:12][cH:13]1.[OH2:1].[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[C:2]([CH:3]([OH:4])[N:24]1[CH:21]([S:20][C:17]([CH3:18])=[O:19])[CH2:22][C:23]1=[O:25])(=[O:5])[O:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([N+:14](=[O:15])[O-:16])[cH:12][cH:13]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 962WaterHCID 12544839(4-Nitrophenyl)methyl oxoacetateHCID 131320584-Acetylthio-2-azetidinone

Product 1

HCID 13132061HCID 13132061, compound

Sources & evidence

ORD record
ord-014cce07698d498a8bff3fc060a6c5d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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