Ethanol → 6-(2-Hydroxy-1,1-dimethyl-ethyl)-2-(4-methoxy-benzyl)-3,4-dihydro-2H-isoquinolin-1-one

Reaction equation

[BH4-:29].[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]2[C:9](=[O:23])[c:10]3[cH:11][cH:12][c:13]([C:18]([CH:19]=[O:20])([CH3:21])[CH3:22])[cH:14][c:15]3[CH2:16][CH2:17]2)[cH:24][cH:25]1.[CH3:26][CH2:27][OH:28].[Na+:30]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]2[C:9](=[O:23])[c:10]3[cH:11][cH:12][c:13]([C:18]([CH2:19][OH:20])([CH3:21])[CH3:22])[cH:14][c:15]3[CH2:16][CH2:17]2)[cH:24][cH:25]1

Participants

Reactant 5

HCID 702Ethanol

HCID 923Sodium Ion

HCID 8028Tetrahydrofuran

HCID 28123Borohydride

HCID 592164762-[2-(4-Methoxy-benzyl)-1-oxo-1,2,3,4-tetrahydro-isoquinolin-6-yl]-2-methyl-propionaldehyde

Product 1

HCID 671349876-(2-Hydroxy-1,1-dimethyl-ethyl)-2-(4-methoxy-benzyl)-3,4-dihydro-2H-isoquinolin-1-one

Sources & evidence

ORD record: ord-81e2a03970ac49bbb815b668028738e9
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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