Acetate → HCID 178525114, compound

HRID 214568Notes

Reaction equation

HRID 214568 reaction equation
[CH2:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[O:29][C:30](=[O:31])[N:32]1[CH:33]([CH2:37][c:38]2[cH:39][nH:40][c:41]3[cH:42][cH:43][c:44]([Br:47])[cH:45][c:46]23)[CH2:34][CH2:35][CH2:36]1.[CH3:79][CH2:80][N:81]([CH2:82][CH3:83])[CH2:84][CH3:85].[O-:71][C:72]([CH3:73])=[O:74].[O-:75][C:76]([CH3:77])=[O:78].[OH:1][CH2:2][c:3]1[cH:4][c:5]([Sn:9]([CH2:10][CH2:11][CH2:12][CH3:13])([CH2:14][CH2:15][CH2:16][CH3:17])[CH2:18][CH2:19][CH2:20][CH3:21])[cH:6][cH:7][cH:8]1.[Pd+2:70].[c:48]1([CH3:49])[cH:50][cH:51][cH:52][cH:53][c:54]1[P:55]([c:56]1[cH:57][cH:58][cH:59][cH:60][c:61]1[CH3:62])[c:63]1[cH:64][cH:65][cH:66][cH:67][c:68]1[CH3:69]>>[OH:1][CH2:2][c:3]1[cH:4][c:5](-[c:44]2[cH:43][cH:42][c:41]3[nH:40][cH:39][c:38]([CH2:37][CH:33]4[N:32]([C:30]([O:29][CH2:22][c:23]5[cH:24][cH:25][cH:26][cH:27][cH:28]5)=[O:31])[CH2:36][CH2:35][CH2:34]4)[c:46]3[cH:45]2)[cH:6][cH:7][cH:8]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 8471TriethylamineHCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 19077565benzyl 2-[(5-bromo-1H-indol-3-yl)methyl]pyrrolidine-1-carboxylateHCID 22420944HCID 22420944, compound

Product 1

HCID 178525114HCID 178525114, compound

Sources & evidence

ORD record
ord-fdda0e30239e419aac75f3a7fd315f8a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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