Water → 4-Tert-butoxycarbonylamino-4-(4-chloro-benzylcarbamoyl)-piperidine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:12][CH2:13]1.[CH2:49]([N:50]([CH:51]([CH3:52])[CH3:53])[CH:54]([CH3:55])[CH3:56])[CH3:57].[Cl:58][c:59]1[cH:60][cH:61][c:62]([CH2:63][NH2:64])[cH:65][cH:66]1.[Cl:68][CH2:69][Cl:70].[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[OH2:67].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[NH:64][CH2:63][c:62]2[cH:61][cH:60][c:59]([Cl:58])[cH:66][cH:65]2)([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:12][CH2:13]1Participants
9
Reactant 8
HCID 962Water
HCID 6228Dimethylformamide
HCID 6344Dichloromethane
HCID 9886Hexafluorophosphate
HCID 660364-Chlorobenzylamine
HCID 81531Diisopropylethylamine
HCID 12682251-(tert-Butoxycarbonyl)-4-((tert-butoxycarbonyl)amino)piperidine-4-carboxylic acid
HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumProduct 1
Sources & evidence
- ORD record
- ord-1f551ea817554e318901206edcec1fd5
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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