Water → Tert-butyl 3-[1-(1,3-dioxoisoindol-2-yl)isoquinolin-6-yl]oxypiperidine-1-carboxylate

HRID 698470Notes

Reaction equation

HRID 698470 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([O:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][n:20][c:21]([NH2:25])[c:22]3[cH:23][cH:24]2)[CH2:11][CH2:12][CH2:13]1.[C:33]([c:34]1[c:35]([C:36](=[O:37])[Cl:44])[cH:39][cH:40][cH:41][cH:42]1)([Cl:38])=[O:43].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[OH2:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([O:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][n:20][c:21]([N:25]4[C:33](=[O:43])[c:34]5[c:35]([cH:39][cH:40][cH:41][cH:42]5)[C:36]4=[O:37])[c:22]3[cH:23][cH:24]2)[CH2:11][CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 962WaterHCID 6955Phthaloyl chlorideHCID 8471TriethylamineHCID 775634643-(1-Amino-isoquinolin-6-yloxy)piperidin-1--carboxylic acid tert-butyl ester

Product 1

HCID 68874397Tert-butyl 3-[1-(1,3-dioxoisoindol-2-yl)isoquinolin-6-yl]oxypiperidine-1-carboxylate

Sources & evidence

ORD record
ord-c5e5ce5b5f9f4dd0bb7c16eaac98ed37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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