Chloride → methyl (3aRS,4SR,7RS,7aRS)-2-benzyl-7-hydroxy-7-(3-methoxyphenyl)-4-phenyloctahydroisoindole-3a-carboxylate

HRID 1559500Notes

Reaction equation

HRID 1559500 reaction equation
[Br:1][c:2]1[cH:3][c:4]([O:8][CH3:9])[cH:5][cH:6][cH:7]1.[CH3:15][O:16][C:17](=[O:18])[C:19]12[CH2:20][N:21]([CH2:35][c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH2:22][CH:23]1[C:24](=[O:34])[CH2:25][CH2:26][CH:27]2[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH3:42][CH2:43][O:44][CH2:45][CH3:46].[Ce+3:12].[Cl-:11].[Cl-:13].[Cl-:14].[Mg:10]>>[c:2]1([C:24]2([OH:34])[CH:23]3[C:19]([C:17]([O:16][CH3:15])=[O:18])([CH2:20][N:21]([CH2:35][c:36]4[cH:37][cH:38][cH:39][cH:40][cH:41]4)[CH2:22]3)[CH:27]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[CH2:26][CH2:25]2)[cH:3][c:4]([O:8][CH3:9])[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 312Chloride3×HCID 3283Diethyl EtherHCID 169713-BromoanisoleHCID 114853Cerium(3+)HCID 5462224MagnesiumHCID 11302988methyl(3aRS,4SR,7aRS)-2-benzyl-7-oxo-4-phenyloctahydroisoindole-3a-carboxylate

Product 1

HCID 86755047methyl (3aRS,4SR,7RS,7aRS)-2-benzyl-7-hydroxy-7-(3-methoxyphenyl)-4-phenyloctahydroisoindole-3a-carboxylate

Sources & evidence

ORD record
ord-51ff3f7d322749e59b221bae204b6208
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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