Isopropyl Acetate → tert-butyl 4-(3-(dimethylcarbamoyloxy)-phenylcarbamoyl)-4-((1-trityl-1H-imidazol-4-yl)methyl)piperidine-1-carboxylate
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])([CH2:17][c:18]2[n:19][cH:20][n:21]([C:23]([c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:22]2)[CH2:12][CH2:13]1.[C:88]([O:89][CH:90]([CH3:91])[CH3:92])(=[O:93])[CH3:94].[CH3:75][N:76]([C:77]([O:78][c:79]1[cH:80][c:81]([NH2:85])[cH:82][cH:83][cH:84]1)=[O:86])[CH3:87].[CH3:95][CH2:96][O:97][C:98]([CH3:99])=[O:100].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[P-:42]([F:43])([F:44])([F:45])([F:46])([F:47])[F:48].[n:49]1([O:50][C:51]([N:52]([CH3:53])[CH3:54])=[N+:55]([CH3:56])[CH3:57])[c:58]2[n:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]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:85][c:81]2[cH:80][c:79]([O:78][C:77]([N:76]([CH3:75])[CH3:87])=[O:86])[cH:84][cH:83][cH:82]2)([CH2:17][c:18]2[n:19][cH:20][n:21]([C:23]([c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:22]2)[CH2:12][CH2:13]1Participants
8
Reactant 7
HCID 7915Isopropyl Acetate
HCID 8857Ethyl Acetate
HCID 9886Hexafluorophosphate
HCID 298773-Aminophenyl dimethylcarbamate
HCID 81531Diisopropylethylamine
HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium
HCID 689935991-(tert-butoxycarbonyl)-4-((1-trityl-1H-imidazol-4-yl)methyl)piperidine-4-carboxylic acidProduct 1
Sources & evidence
- ORD record
- ord-44431241d43b4381a473007e295f6187
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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