Acetate → 2-[5-(2,3-Dihydro-indol-1-yl)-4'-trifluoromethyl-biphenyl-3-yl]-4-methyl-pentanoic acid methyl ester

HRID 140373Notes

Reaction equation

HRID 140373 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH2:40]1[CH2:41][c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[NH:48]1.[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:7][O:8][C:9]([CH:10]([CH2:11][CH:12]([CH3:13])[CH3:14])[c:15]1[cH:16][c:17](-[c:29]2[cH:30][cH:31][c:32]([C:35]([F:36])([F:37])[F:38])[cH:33][cH:34]2)[cH:18][c:19]([O:21][S:22]([C:23]([F:24])([F:25])[F:26])(=[O:27])=[O:28])[cH:20]1)=[O:39].[Cs+:5].[Cs+:6].[O-:55][C:56]([CH3:57])=[O:58].[O-:59][C:60]([CH3:61])=[O:62].[Pd+2:54]>>[CH3:7][O:8][C:9]([CH:10]([CH2:11][CH:12]([CH3:13])[CH3:14])[c:15]1[cH:16][c:17](-[c:29]2[cH:30][cH:31][c:32]([C:35]([F:36])([F:37])[F:38])[cH:33][cH:34]2)[cH:18][c:19]([N:48]2[CH2:40][CH2:41][c:42]3[cH:43][cH:44][cH:45][cH:46][c:47]32)[cH:20]1)=[O:39]

Participants

8

Reactant 7

HCID 175Acetate2×HCID 8028TetrahydrofuranHCID 10328IndolineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 59004769HCID 59004769, compound

Product 1

HCID 576666612-[5-(2,3-Dihydro-indol-1-yl)-4'-trifluoromethyl-biphenyl-3-yl]-4-methyl-pentanoic acid methyl ester

Sources & evidence

ORD record
ord-548b66ca4a1b4b14bd32bae8349712f7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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