Sodium ion → 3-hydroxy-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile

HRID 86428

Reaction equation

HRID 86428 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:15]1)[CH:8]1[CH:9]([C:10]([CH3:12])([CH3:13])[O:11]2)[O:14]1.[CH2:27]([O:28][CH2:29][CH3:30])[CH3:31].[CH3:16][O:17][C:18]1=[CH:19][C:20](=[O:23])[NH:21][CH2:22]1.[H-:24].[Na+:25].[OH2:26]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:15]1)[CH:8]([N:21]1[C:20](=[O:23])[CH:19]=[C:18]([O:17][CH3:16])[CH2:22]1)[CH:9]([OH:14])[C:10]([CH3:12])([CH3:13])[O:11]2

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 3283Diethyl EtherHCID 166653HydrideHCID 5747694-methoxy-2,5-dihydro-1H-pyrrol-2-oneHCID 108673602,2-Dimethyl-3,4-epoxy-6-cyanochroman

Product 1

HCID 199826883-hydroxy-4-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile

Sources & evidence

ORD record
ord-bf4f7aae9f0d48eeb18b3a6557c93846
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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