Tetrahydrofuran → 2-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-isonicotinic acid methyl ester

HRID 1128163Notes

Reaction equation

HRID 1128163 reaction equation
[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:15][O:16][C:17]([c:18]1[cH:19][c:20]([OH:24])[n:21][cH:22][cH:23]1)=[O:25].[CH3:1][c:2]1[c:3]([CH2:13][OH:14])[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1.[O:45]=[C:46]([O:47][CH2:48][CH3:49])[N:50]=[N:51][C:52]([O:53][CH2:54][CH3:55])=[O:56].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:20]2[cH:19][c:18]([C:17]([O:16][CH3:15])=[O:25])[cH:23][cH:22][n:21]2)[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 2776149(5-Methyl-3-phenyl-1,2-oxazol-4-yl)methanolHCID 178498433HCID 178498433, compound

Product 1

HCID 684433292-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-isonicotinic acid methyl ester

Sources & evidence

ORD record
ord-8e8f6f5279c24a32ab774ec2b78e6a54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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