Iodobenzene → Ethyl 1-[4-[4-[4-(1-hydroxy-2,2-dimethyl-4-phenylbut-3-enyl)-3-methyl-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylate

HRID 1207492Notes

Reaction equation

HRID 1207492 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][cH:17][c:18](-[c:21]4[c:22]([CH:27]([C:28]([CH:29]=[CH2:30])([CH3:31])[CH3:32])[OH:33])[c:23]([CH3:26])[n:24][o:25]4)[cH:19][cH:20]3)[cH:13][cH:14]2)[CH2:7][CH2:8]1.[I:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][cH:17][c:18](-[c:21]4[c:22]([CH:27]([C:28]([CH:29]=[CH:30][c:35]5[cH:36][cH:37][cH:38][cH:39][cH:40]5)([CH3:31])[CH3:32])[OH:33])[c:23]([CH3:26])[n:24][o:25]4)[cH:19][cH:20]3)[cH:13][cH:14]2)[CH2:7][CH2:8]1

Participants

3

Reactant 2

HCID 11575IodobenzeneHCID 665773901-{4'-[4-(1-Hydroxy-2,2-dimethyl-but-3-enyl)-3-methyl-isoxazol-5-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester

Product 1

HCID 67092434Ethyl 1-[4-[4-[4-(1-hydroxy-2,2-dimethyl-4-phenylbut-3-enyl)-3-methyl-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylate

Sources & evidence

ORD record
ord-d7f52690946b4e7db4cdf1a9ade6bedc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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