Bicarbonate Ion → HCID 68571590, compound

HRID 110567Notes

Reaction equation

HRID 110567 reaction equation
[C:66]([P:67]([C:68]([CH3:69])([CH3:70])[CH3:71])[C:72]([CH3:73])([CH3:74])[CH3:75])([CH3:76])([CH3:77])[CH3:78].[CH:51](=[CH2:52])[Sn:53]([CH2:54][CH2:55][CH2:56][CH3:57])([CH2:58][CH2:59][CH2:60][CH3:61])[CH2:62][CH2:63][CH2:64][CH3:65].[Cl:1][c:2]1[c:3]([O:43][CH2:44][CH2:45][CH2:46][O:47][CH3:48])[cH:4][c:5]([CH2:6][O:7][CH:8]2[CH2:9][N:10]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:11][CH2:12][CH:13]2[c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][O:24][CH2:25][c:26]3[c:27]([O:32][CH3:33])[cH:28][cH:29][cH:30][cH:31]3)[cH:18][cH:19]2)[cH:41][cH:42]1.[Cs+:50].[F-:49].[Na+:79].[O:84]1[CH2:85][CH2:86][O:87][CH2:88][CH2:89]1.[OH:80][C:81](=[O:82])[O-:83]>>[c:2]1([CH:51]=[CH2:52])[c:3]([O:43][CH2:44][CH2:45][CH2:46][O:47][CH3:48])[cH:4][c:5]([CH2:6][O:7][CH:8]2[CH2:9][N:10]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:11][CH2:12][CH:13]2[c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][O:24][CH2:25][c:26]3[c:27]([O:32][CH3:33])[cH:28][cH:29][cH:30][cH:31]3)[cH:18][cH:19]2)[cH:41][cH:42]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 28179Fluoride IonHCID 312751,4-DioxaneHCID 81998TributylvinyltinHCID 83681Tris(1,1-dimethylethyl)phosphineHCID 104967Cesium cationHCID 68504735Tert-butyl 3-[4-chloro-3-(3-methoxypropoxy)benzyloxy]-4-{4-[3-(2-methoxybenzyloxy)propoxy]phenyl}piperidine-1-carboxylate

Product 1

HCID 68571590HCID 68571590, compound

Sources & evidence

ORD record
ord-817733d05f6f4e1fa560030a554e147c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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