Chem
J-GLOBAL ID:201507014491673558   Nikkaji number:J3.445.985A

(E)-3-[4-[Bis[4′-(diphenylamino)biphenyl-4-yl]amino]phenyl]-2-(trifluoromethyl)acrylic acid

(E)-3-[4-[ビス[4′-(ジフェニルアミノ)ビフェニル-4-イル]アミノ]フェニル]-2-(トリフルオロメチル)アクリル酸
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: C58H42F3N3O2
Molecular formula furigana: C58-H42-F3-N3-O2
Molecular weight: 869.988
InChI: InChI=1S/C58H42F3N3O2/c59-58(60,61)56(57(65)66)41-42-21-31-51(32-22-42)64(54-37-27-45(28-38-54)43-23-33-52(34-24-43)62(47-13-5-1-6-14-47)48-15-7-2-8-16-48)55-39-29-46(30-40-55)44-25-35-53(36-26-44)63(49-17-9-3-10-18-49)50-19-11-4-12-20-50/h1-41H,(H,65,66)/b56-41+
InChI key: NQUISFRGJISZDC-LCFLESIQSA-N
SMILES: OC(=O)/C(=C\c1ccc(cc1)N(c1ccc(cc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)/C(F)(F)F
Systematic name  (3):
  • (E)-3-[4-[ビス[4′-(ジフェニルアミノ)ビフェニル-4-イル]アミノ]フェニル]-2-(トリフルオロメチル)アクリル酸
  • (2E)-3-(4-{ビス[4'-(ジフェニルアミノ)-[1,1'-ビフェニル]-4-イル]アミノ}フェニル)-2-(トリフルオロメチル)プロパ-2-エン酸
  • (2E)-3-(4-{bis[4'-(diphenylamino)-[1,1'-biphenyl]-4-yl]amino}phenyl)-2-(trifluoromethyl)prop-2-enoic acid
Other name (1):
  • (E)-3-[4-[Bis[4′-(diphenylamino)biphenyl-4-yl]amino]phenyl]-2-(trifluoromethyl)acrylic acid
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