Acetonitrile → 3-(1-Chloroisoquinolin-6-yloxy)piperidine-1-carboxylic acid tert-butyl ester

HRID 1231827Notes

Reaction equation

HRID 1231827 reaction equation
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[N:20]1[CH2:21][CH:22]([O:26][S:27]([CH3:28])(=[O:29])=[O:30])[CH2:23][CH2:24][CH2:25]1.[C:31]([N:32]=[P:33]1([N:34]([CH2:35][CH3:36])[CH2:37][CH3:38])[N:39]([CH3:40])[CH2:41][CH2:42][CH2:43][N:44]1[CH3:45])([CH3:46])([CH3:47])[CH3:48].[CH3:49][C:50]#[N:51].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([OH:12])[cH:9][cH:10][c:11]12>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([O:12][CH:22]3[CH2:21][N:20]([C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:19])[CH2:25][CH2:24][CH2:23]3)[cH:9][cH:10][c:11]12

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 568122N-Boc-3-mesyloxypiperidineHCID 35138512-((1,1-Dimethylethyl)imino)-N,N-diethylhexahydro-1,3-dimethyl-2lambda5-1,3,2-diazaphosphorin-2-amineHCID 1357421771-chloro-2H-isoquinolin-6-one

Product 1

HCID 866129773-(1-Chloroisoquinolin-6-yloxy)piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-19d952ced22241f09665944859c1bbe5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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