Benzene → HCID 13097099, compound

HRID 2350399Notes

Reaction equation

HRID 2350399 reaction equation
[N:19]([O-:20])=[O:21].[Na+:22].[O:1]=[c:2]1[s:3][c:4]2[c:5]([n:6]1[CH2:7][C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:13][c:14]([Cl:18])[c:15]([NH2:17])[cH:16]2.[OH2:29].[cH:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[O:1]=[c:2]1[s:3][c:4]2[c:5]([n:6]1[CH2:7][C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:13][c:14]([Cl:18])[c:15](-[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[cH:16]2

Participants

6

Reactant 5

HCID 241BenzeneHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 13097103HCID 13097103, compound

Product 1

HCID 13097099HCID 13097099, compound

Sources & evidence

ORD record
ord-4741a81445444f158b127e7195bd5f11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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