Chem
J-GLOBAL ID:200907018699887443   Nikkaji number:J1.984.989I

4-[3-[3-(Trifluoromethyl)phenyl]-5-phenyl-2-pyrazoline-1-yl]-4′-nitroazobenzene

4-[3-[3-(トリフルオロメチル)フェニル]-5-フェニル-2-ピラゾリン-1-イル]-4′-ニトロアゾベンゼン
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: C28H20F3N4[N+]O[O-]
Molecular formula furigana: C28-H20-F3-N5-O2
Molecular weight: 515.496
InChI: InChI=1S/C28H20F3N5O2/c29-28(30,31)21-8-4-7-20(17-21)26-18-27(19-5-2-1-3-6-19)35(34-26)24-13-9-22(10-14-24)32-33-23-11-15-25(16-12-23)36(37)38/h1-17,27H,18H2
InChI key: XCDMGJXUUKDVEN-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1ccc(cc1)N=Nc1ccc(cc1)N1N=C(CC1c1ccccc1)c1cccc(c1)C(F)(F)F
Systematic name  (3):
  • 4-[3-[3-(トリフルオロメチル)フェニル]-5-フェニル-2-ピラゾリン-1-イル]-4′-ニトロアゾベンゼン
  • 1-{4-[2-(4-ニトロフェニル)ジアゼン-1-イル]フェニル}-5-フェニル-3-[3-(トリフルオロメチル)フェニル]-4,5-ジヒドロ-1H-ピラゾール
  • 1-{4-[2-(4-nitrophenyl)diazen-1-yl]phenyl}-5-phenyl-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyrazole
Other name (1):
  • 4-[3-[3-(Trifluoromethyl)phenyl]-5-phenyl-2-pyrazoline-1-yl]-4′-nitroazobenzene
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