Bicarbonate Ion → Benzyl 3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]-4-[4-(4-methylcarbamoylbut-1-ynyl)phenyl]piperidine-1-carboxylate

HRID 1551586Notes

Reaction equation

HRID 1551586 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][O:9][c:10]2[c:11]1[cH:12][c:13]([CH2:16][O:17][CH:18]1[CH2:19][N:20]([C:38](=[O:39])[O:40][CH2:41][c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[CH2:21][CH2:22][CH:23]1[c:24]1[cH:25][cH:26][c:27]([O:30][S:31]([C:32]([F:33])([F:34])[F:35])(=[O:36])=[O:37])[cH:28][cH:29]1)[cH:14][cH:15]2.[CH3:48][NH:49][C:50](=[O:51])[CH2:52][CH2:53][CH2:54][C:55]#[CH:56].[CH3:73][N:74]([CH3:75])[CH:76]=[O:77].[CH:57]([N:58]([CH2:59][CH3:60])[CH:61]([CH3:62])[CH3:63])([CH3:64])[CH3:65].[Cu:71][I:72].[Na+:66].[OH:67][C:68](=[O:69])[O-:70]>>[CH3:1][O:2][CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][O:9][c:10]2[c:11]1[cH:12][c:13]([CH2:16][O:17][CH:18]1[CH2:19][N:20]([C:38](=[O:39])[O:40][CH2:41][c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[CH2:21][CH2:22][CH:23]1[c:24]1[cH:25][cH:26][c:27]([C:55]#[C:54][CH2:53][CH2:52][C:50]([NH:49][CH3:48])=[O:51])[cH:28][cH:29]1)[cH:14][cH:15]2

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 81531DiisopropylethylamineHCID 14342989N-methylpent-4-ynecarboxamideHCID 86610023benzyl 3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]-4-(4-trifluoromethanesulphonyloxyphenyl)piperidin-1-carboxylate

Product 1

HCID 68498993Benzyl 3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]-4-[4-(4-methylcarbamoylbut-1-ynyl)phenyl]piperidine-1-carboxylate

Sources & evidence

ORD record
ord-9747a404fb1345aab85184a3d1bef452
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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