Carbonate Ion → HCID 67234399, compound

HRID 2310165Notes

Reaction equation

HRID 2310165 reaction equation
[C:42](=[O:43])([O-:44])[O-:45].[Cs+:46].[Cs+:47].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[n:18][n:19][c:20]4[n:21]3[cH:22][cH:23][cH:24][cH:25]4)[n:15][c:16]12)(=[O:26])=[O:27].[NH:28]1[CH2:29][CH:30]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[CH2:31][CH2:32][CH2:33]1.[c:48]1([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][c:59]3[c:60]([cH:61][cH:62][cH:63][cH:64]3)[c:65]2-[c:66]2[c:67]3[c:68]([cH:69][cH:70][cH:71][cH:72]3)[cH:73][cH:74][c:75]2[P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[cH:89][cH:90][cH:91][cH:92][cH:93]1>>[c:7]1([N:28]2[CH2:29][CH:30]([NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[CH2:31][CH2:32][CH2:33]2)[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[n:18][n:19][c:20]4[n:21]3[cH:22][cH:23][cH:24][cH:25]4)[n:15][c:16]12

Participants

6

Reactant 5

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 634876Binap, (A+-)-HCID 42330413-(Boc-amino)piperidineHCID 866543542-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)quinolin-8-yl trifluoromethanesulfonate

Product 1

HCID 67234399HCID 67234399, compound

Sources & evidence

ORD record
ord-488d6844610f467994a7c272ad012e75
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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