Chem
J-GLOBAL ID:200907061323962030
Nikkaji number:J332.223H
Brequinar
ブレキナル
Download MOL file
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:
C23 H15 F2 NO2
Molecular formula furigana:
C23-H15-F2-N-O2
Molecular weight:
375.375
InChI:
InChI=1S/C23H15F2NO2/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25/h2-12H,1H3,(H,27,28)
InChI key:
PHEZJEYUWHETKO-UHFFFAOYSA-N
SMILES:
Cc1c(nc2ccc(F)cc2c1C(=O)O)c1ccc(cc1)c1ccccc1F
Systematic name (3):
6-フルオロ-2-(2′-フルオロ[1,1′-ビフェニル]-4-イル)-3-メチル-4-キノリンカルボン酸
6-フルオロ-2-{2'-フルオロ-[1,1'-ビフェニル]-4-イル}-3-メチルキノリン-4-カルボン酸
6-fluoro-2-{2'-fluoro-[1,1'-biphenyl]-4-yl}-3-methylquinoline-4-carboxylic acid
Other name (4):
Brequinar
ブレキナル
6-Fluoro-2-(2′-fluoro[1,1′-biphenyl]-4-yl)-3-methyl-4-quinolinecarboxylic acid
ブレキナール
CAS registry number:
96187-53-0
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