N-methyl-2-pyrrolidone → 7-[4-[[4-[5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]-4-hydroxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid

HRID 2348989Notes

Reaction equation

HRID 2348989 reaction equation
[C:28]([O:29][B:30]([OH:31])[O:32][C:33](=[O:34])[CH3:35])(=[O:36])[CH3:37].[CH2:59]([N:60]([CH:61]([CH3:62])[CH3:63])[CH:64]([CH3:65])[CH3:66])[CH3:67].[CH3:68][N:69]1[CH2:70][CH2:71][CH2:72][C:73]1=[O:74].[CH:38]1([n:41]2[cH:42][c:43]([C:56](=[O:57])[OH:58])[c:44](=[O:55])[c:45]3[cH:46][c:47]([F:54])[c:48]([F:53])[c:49]([O:51][CH3:52])[c:50]23)[CH2:39][CH2:40]1.[F:1][c:2]1[cH:3][c:4]([N:17]2[C:18](=[O:27])[O:19][CH:20]([CH2:22][NH:23][C:24]([CH3:25])=[O:26])[CH2:21]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]1([OH:16])[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]1>>[F:1][c:2]1[cH:3][c:4]([N:17]2[C:18](=[O:27])[O:19][CH:20]([CH2:22][NH:23][C:24]([CH3:25])=[O:26])[CH2:21]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]1([OH:16])[CH2:11][CH2:12][N:13]([c:48]2[c:47]([F:54])[cH:46][c:45]3[c:44](=[O:55])[c:43]([C:56](=[O:57])[OH:58])[cH:42][n:41]([CH:38]4[CH2:39][CH2:40]4)[c:50]3[c:49]2[O:51][CH3:52])[CH2:14][CH2:15]1

Participants

6

Reactant 5

HCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 70194651-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acidHCID 67279370Diacetyloxyborinic acidHCID 85421408N-[[3-[3-fluoro-4-[(4-hydroxypiperidin-4-yl)methoxy]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Product 1

HCID 724617247-[4-[[4-[5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy]methyl]-4-hydroxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-156db4537bdd4703b4b9bd85c36c8b0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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