Acetonitrile → HCID 59496607, compound

HRID 2336449Notes

Reaction equation

HRID 2336449 reaction equation
[Br:19][CH2:20][c:21]1[cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27][cH:28]1.[C:32](=[O:33])([O-:34])[O-:35].[CH3:29][C:30]#[N:31].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Cs+:36].[Cs+:37].[OH:1][c:2]1[c:3]2[c:8]([cH:9][cH:10][cH:11]1)[CH2:7][N:6]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:5][CH2:4]2>>[O:1]([c:2]1[c:3]2[c:8]([cH:9][cH:10][cH:11]1)[CH2:7][N:6]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:5][CH2:4]2)[CH2:20][c:21]1[cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27][cH:28]1

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 97249Benzonitrile, 3-(bromomethyl)-HCID 104967Cesium cation2×HCID 10538586tert-Butyl 5-hydroxy-3,4-dihydroisoquinoline-2(1H)-carboxylate

Product 1

HCID 59496607HCID 59496607, compound

Sources & evidence

ORD record
ord-efc46cffb8b048a2bf51d5f47464a9f7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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