Chem
J-GLOBAL ID:200907002567605348
Nikkaji number:J848.677H
2-[[4-[[3-Phenyl-7-(trifluoromethyl)quinoxalin-2-yl]amino]benzoyl]amino]pentanedioic acid
2-[[4-[[3-フェニル-7-(トリフルオロメチル)キノキサリン-2-イル]アミノ]ベンゾイル]アミノ]ペンタン二酸
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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:
C27 H21 F3 N4 O5
Molecular formula furigana:
C27-H21-F3-N4-O5
Molecular weight:
538.483
InChI:
InChI=1S/C27H21F3N4O5/c28-27(29,30)17-8-11-19-21(14-17)33-24(23(32-19)15-4-2-1-3-5-15)31-18-9-6-16(7-10-18)25(37)34-20(26(38)39)12-13-22(35)36/h1-11,14,20H,12-13H2,(H,31,33)(H,34,37)(H,35,36)(H,38,39)
InChI key:
QKEWUYZUXTWZJS-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(NC(=O)c1ccc(Nc2nc3cc(ccc3nc2c2ccccc2)C(F)(F)F)cc1)C(=O)O
Systematic name (3):
2-[[4-[[3-フェニル-7-(トリフルオロメチル)キノキサリン-2-イル]アミノ]ベンゾイル]アミノ]ペンタン二酸
2-[(4-{[3-フェニル-7-(トリフルオロメチル)キノキサリン-2-イル]アミノ}フェニル)ホルムアミド]ペンタン二酸
2-[(4-{[3-phenyl-7-(trifluoromethyl)quinoxalin-2-yl]amino}phenyl)formamido]pentanedioic acid
Other name (1):
2-[[4-[[3-Phenyl-7-(trifluoromethyl)quinoxalin-2-yl]amino]benzoyl]amino]pentanedioic acid
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