Methanol → methyl 2-[4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]-1-(4-methylphenyl)sulfonylpiperidin-2-yl]acetate

HRID 304101Notes

Reaction equation

HRID 304101 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH2:10][CH:11]([CH2:42][C:43](=[O:44])[OH:45])[N:12]([S:32](=[O:33])(=[O:34])[c:35]3[cH:36][cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[CH2:13][CH:14]2[O:15][CH2:16][c:17]2[cH:18][cH:19][c:20]3[c:21]([cH:31]2)[N:22]([CH2:26][CH2:27][CH2:28][O:29][CH3:30])[CH2:23][CH2:24][O:25]3)[cH:7][cH:8]1.[CH3:55][OH:56].[Mg+2:49].[N+:46](=[N-:47])=[CH2:48].[O-:50][S:51](=[O:52])(=[O:53])[O-:54]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH2:10][CH:11]([CH2:42][C:43]([O:44][CH3:48])=[O:45])[N:12]([S:32](=[O:33])(=[O:34])[c:35]3[cH:36][cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[CH2:13][CH:14]2[O:15][CH2:16][c:17]2[cH:18][cH:19][c:20]3[c:21]([cH:31]2)[N:22]([CH2:26][CH2:27][CH2:28][O:29][CH3:30])[CH2:23][CH2:24][O:25]3)[cH:7][cH:8]1

Participants

6

Reactant 5

HCID 887MethanolHCID 888Magnesium CationHCID 1117Sulfate IonHCID 9550DiazomethaneHCID 178495225HCID 178495225, compound

Product 1

HCID 178495226methyl 2-[4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]-1-(4-methylphenyl)sulfonylpiperidin-2-yl]acetate

Sources & evidence

ORD record
ord-0a81ee16ea02483ba7f3fda4dee1f252
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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