Toluene → HCID 57672929, compound

HRID 1229281Notes

Reaction equation

HRID 1229281 reaction equation
[C:18](=[O:19])([O:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[NH:40]1[C:41](=[O:46])[CH2:42][CH2:43][CH2:44][CH2:45]1.[c:1]1([CH2:7][O:8][C:9](=[O:10])[C:11]2([NH2:17])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][O:8][C:9](=[O:10])[C:11]2([NH:17][C:18](=[O:19])[N:40]3[C:41](=[O:46])[CH2:42][CH2:43][CH2:44][CH2:45]3)[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 1140TolueneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 126652-PiperidoneHCID 90495Di-tert-butyl dicarbonateHCID 15176238Benzyl 1-aminocyclohexanecarboxylate

Product 1

HCID 57672929HCID 57672929, compound

Sources & evidence

ORD record
ord-76d5ef6699534392a439d085ca92fe31
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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