Sodium ion → Benzyl 3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]-4-[4-(3-phenylpyrrolidin-1-ylmethyl)phenyl]piperidine-1-carboxylate

HRID 668945Notes

Reaction equation

HRID 668945 reaction equation
[CH3:55][N:56]([CH3:57])[CH:58]=[O:59].[CH3:60][O:61][C:62]([CH3:63])([CH3:64])[CH3:65].[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([O:25][CH2:26][c:27]3[cH:28][cH:29][c:30]4[c:31]([cH:41]3)[N:32]([CH2:36][CH2:37][CH2:38][O:39][CH3:40])[CH2:33][CH2:34][O:35]4)[CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:13][CH2:14]2)[cH:7][cH:8]1.[H-:53].[Na+:54].[c:42]1([CH:48]2[CH2:49][NH:50][CH2:51][CH2:52]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([O:25][CH2:26][c:27]3[cH:28][cH:29][c:30]4[c:31]([cH:41]3)[N:32]([CH2:36][CH2:37][CH2:38][O:39][CH3:40])[CH2:33][CH2:34][O:35]4)[CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:13][CH2:14]2)[cH:7][cH:8]1)[N:50]1[CH2:49][CH:48]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[CH2:52][CH2:51]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 6228DimethylformamideHCID 15413tert-Butyl methyl etherHCID 166653HydrideHCID 31467433-PhenylpyrrolidineHCID 68501265HCID 68501265, compound

Product 1

HCID 68503996Benzyl 3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]-4-[4-(3-phenylpyrrolidin-1-ylmethyl)phenyl]piperidine-1-carboxylate

Sources & evidence

ORD record
ord-4ab59f6677464cc196cbdf9dbc2eb95f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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