Acetate → HCID 178429137, compound

HRID 293819Notes

Reaction equation

HRID 293819 reaction equation
[C:53](=[O:54])([O-:55])[O-:56].[CH2:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[N:31]1[CH2:32][C:33]2([CH2:34][NH:35][c:36]3[cH:37][cH:38][cH:39][c:40]([CH2:42][NH:43][C:44]([O:45][C:46]([CH3:47])([CH3:48])[CH3:49])=[O:50])[c:41]32)[CH2:51][CH2:52]1.[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[Cs+:57].[Cs+:58].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[O:10][CH:11]2[CH2:12][CH:13]([CH3:21])[c:14]3[c:15]2[n:16][cH:17][n:18][c:19]3[Cl:20])[cH:22][cH:23]1.[O-:67][C:68]([CH3:69])=[O:70].[O-:71][C:72]([CH3:73])=[O:74].[Pd+2:66]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[O:10][CH:11]2[CH2:12][CH:13]([CH3:21])[c:14]3[c:15]2[n:16][cH:17][n:18][c:19]3[N:35]2[CH2:34][C:33]3([CH2:32][N:31]([CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:52][CH2:51]3)[c:41]3[c:36]2[cH:37][cH:38][cH:39][c:40]3[CH2:42][NH:43][C:44]([O:45][C:46]([CH3:47])([CH3:48])[CH3:49])=[O:50])[cH:22][cH:23]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 1140TolueneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 86651810Tert-butyl (1'-benzylspiro[indoline-3,3'-pyrrolidine]-4-yl)methylcarbamateHCID 87400265(4-chloro-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-yl) 4-nitrobenzoate

Product 1

HCID 178429137HCID 178429137, compound

Sources & evidence

ORD record
ord-54feb6b2efa34dfdb8ff1979a481db98
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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