Bicarbonate Ion → 1,1-Dimethylethyl 4-[4,5-dihydro-4-(methoxycarbonyl)-2-oxazolyl)-1-piperidinecarboxylate

HRID 2321365Notes

Reaction equation

HRID 2321365 reaction equation
[C:52]([Cl:53])([Cl:54])([Cl:55])[Cl:56].[C:57](=[O:58])([OH:59])[O-:60].[CH3:62][C:63]#[N:64].[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH:43]([N:44]([CH2:45][CH3:46])[CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51].[Cl:72][CH2:73][Cl:74].[Na+:61].[OH2:71].[OH:1][CH2:2][CH:3]([C:4](=[O:5])[O:6][CH3:7])[NH:8][C:9](=[O:10])[CH:11]1[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]1.[c:24]1([P:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH2:2]1[CH:3]([C:4](=[O:5])[O:6][CH3:7])[N:8]=[C:9]([CH:11]2[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]2)[O:10]1

Participants

11

Reactant 10

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 5943Carbon TetrachlorideHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 11776TriphenylphosphineHCID 81531DiisopropylethylamineHCID 674637131,1-Dimethylethyl 4-[[(1-(hydroxymethyl)-2-methoxy-2-oxoethyl)amino]carbonyl]-1-piperidinecarboxylate

Product 1

HCID 674608611,1-Dimethylethyl 4-[4,5-dihydro-4-(methoxycarbonyl)-2-oxazolyl)-1-piperidinecarboxylate

Sources & evidence

ORD record
ord-50cf53871a494b25a1ba29fe639dd9d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…