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Methanol → 3-[(7-{[(4-Chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzoic acid

HRID 2148027
Notes
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Reaction equation

HRID 2148027 reaction equation
[CH3:35][OH:36].[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][c:12]2[cH:13][c:14]3[c:15]([cH:31][cH:32]2)[N:16]([CH2:20][c:21]2[cH:22][c:23]([C:24](=[O:25])[O:26][CH3:27])[cH:28][cH:29][cH:30]2)[CH2:17][CH2:18][O:19]3)[nH:5][c:6]1[CH2:7][CH3:8].[Li+:33].[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[OH-:34]>>[Cl:1][c:2]1[n:3][c:4]([C:9](=[O:10])[NH:11][c:12]2[cH:13][c:14]3[c:15]([cH:31][cH:32]2)[N:16]([CH2:20][c:21]2[cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:28][cH:29][cH:30]2)[CH2:17][CH2:18][O:19]3)[nH:5][c:6]1[CH2:7][CH3:8]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 887MethanolHCID 961HydroxideHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 67549156Methyl 3-[(7-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzoate

Product 1

HCID 59615442
3-[(7-{[(4-Chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzoic acid

Sources & evidence

ORD record
ord-c2d0e42575314314ad3b5707c0f8a280
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes