Acetonitrile → 7-[2-(t-Butoxycarbonyl)-8-(methoxyimino)-2,6-diazaspiro[3,4]oct-6-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

HRID 674286Notes

Reaction equation

HRID 674286 reaction equation
[CH3:20][O:21][N:22]=[C:23]1[CH2:24][NH:25][CH2:26][C:27]12[CH2:28][N:29]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:30]2.[CH3:38][C:39]#[N:40].[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([F:14])[cH:12][c:13]23)[CH2:2][CH2:3]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([N:25]4[CH2:24][C:23](=[N:22][O:21][CH3:20])[C:27]5([CH2:26]4)[CH2:28][N:29]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:30]5)[cH:12][c:13]23)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 52104221-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acidHCID 545476562,6-Diazaspiro[3.4]octane-2-carboxylic acid, 8-(methoxyimino)-, 1,1-dimethylethyl ester

Product 1

HCID 865847327-[2-(t-Butoxycarbonyl)-8-(methoxyimino)-2,6-diazaspiro[3,4]oct-6-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

Sources & evidence

ORD record
ord-19077ad039b04a59aa7526addf9cef94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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