Chem
J-GLOBAL ID:200907020599165933
Nikkaji number:J550.864I
6-Fluoro-8-(difluoromethoxy)-1-cyclopropyl-7-(3α-methylpiperazin-1-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
6-フルオロ-8-(ジフルオロメトキシ)-1-シクロプロピル-7-(3α-メチルピペラジン-1-イル)-1,4-ジヒドロ-4-オキソキノリン-3-カルボン酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C19 H20 F3 N3 O4
Molecular formula furigana:
C19-H20-F3-N3-O4
Molecular weight:
411.381
InChI:
InChI=1S/C19H20F3N3O4/c1-9-7-24(5-4-23-9)15-13(20)6-11-14(17(15)29-19(21)22)25(10-2-3-10)8-12(16(11)26)18(27)28/h6,8-10,19,23H,2-5,7H2,1H3,(H,27,28)/t9-/m0/s1
InChI key:
QBDBUKJBJJWZMG-VIFPVBQESA-N
SMILES:
C[C@H]1CN(CCN1)c1c(F)cc2c(c1OC(F)F)n(cc(C(=O)O)c2=O)C1CC1
Systematic name (3):
6-フルオロ-8-(ジフルオロメトキシ)-1-シクロプロピル-7-(3α-メチルピペラジン-1-イル)-1,4-ジヒドロ-4-オキソキノリン-3-カルボン酸
1-シクロプロピル-8-(ジフルオロメトキシ)-6-フルオロ-7-[(3S)-3-メチルピペラジン-1-イル]-4-オキソ-1,4-ジヒドロキノリン-3-カルボン酸
1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-7-[(3S)-3-methylpiperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Other name (1):
6-Fluoro-8-(difluoromethoxy)-1-cyclopropyl-7-(3α-methylpiperazin-1-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
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