Sodium ion → 3,3-Difluoro-1,6-diaza-spiro[3.5]nonane-1,6-dicarboxylic acid 1-benzyl ester 6-tert-butyl ester

HRID 663328Notes

Reaction equation

HRID 663328 reaction equation
[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]1[CH2:11][C:12]([C:16]([CH2:17][O:18][S:19]([CH3:20])(=[O:21])=[O:22])([F:23])[F:24])([NH:25][C:26](=[O:27])[O:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[CH2:13][CH2:14][CH2:15]1.[CH3:37][N:38]([CH3:39])[CH:40]=[O:41].[H-:1].[Na+:2].[OH2:36]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]1[CH2:11][C:12]2([CH2:13][CH2:14][CH2:15]1)[C:16]([F:23])([F:24])[CH2:17][N:25]2[C:26](=[O:27])[O:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 582933543-Benzyloxycarbonylamino-3-(1,1-difluoro-2-methanesulfonyloxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 582933383,3-Difluoro-1,6-diaza-spiro[3.5]nonane-1,6-dicarboxylic acid 1-benzyl ester 6-tert-butyl ester

Sources & evidence

ORD record
ord-d53df010b47940538a29288159429832
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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