Potassium Cation → racemic {1-methyl-2-[7-cyanomethoxy-1H-indol-3-yl]ethyl}-carbamic acid tert-butyl ester

HRID 205504

Reaction equation

HRID 205504 reaction equation
[Br:22][CH2:23][C:24]#[N:25].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][nH:12][c:13]2[c:14]([OH:19])[cH:15][cH:16][cH:17][c:18]12)[CH3:20])=[O:21].[C:26](=[O:27])([O-:28])[O-:29].[CH2:32]([C:33]([CH3:34])=[O:35])[CH3:36].[K+:30].[K+:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][nH:12][c:13]2[c:14]([O:19][CH2:23][C:24]#[N:25])[cH:15][cH:16][cH:17][c:18]12)[CH3:20])=[O:21]

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6569Methyl Ethyl KetoneHCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 11460479{1-Methyl-2-[7-hydroxy-1h-indol-3-yl]ethyl}-carbamic acid tert-butyl ester

Product 1

HCID 69518565racemic {1-methyl-2-[7-cyanomethoxy-1H-indol-3-yl]ethyl}-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-ed1b5f68ec2e4cb78a9f670ac539c897
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

Loading…