Chem
J-GLOBAL ID：200907053726405375   Nikkaji number：J1.801.588I

4-[[4-[(Triphenylphosphoranylidene)acetyl]phenyl]ethynyl]benzonitrile

4-[[4-[(トリフェニルホスホラニリデン)アセチル]フェニル]エチニル]ベンゾニトリル
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： C35H24NOP
Molecular formula furigana： C35-H24-N-O-P
Molecular weight： 505.557
InChI： InChI=1S/C35H24NOP/c36-26-30-20-18-28(19-21-30)16-17-29-22-24-31(25-23-29)35(37)27-38(32-10-4-1-5-11-32,33-12-6-2-7-13-33)34-14-8-3-9-15-34/h1-15,18-25,27H
InChI key： NKDFVFDEBNHDRJ-UHFFFAOYSA-N
SMILES： O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(cc1)C#Cc1ccc(cc1)C#N
Systematic name  (3)：
  • 4-[[4-[(トリフェニルホスホラニリデン)アセチル]フェニル]エチニル]ベンゾニトリル
  • 4-(2-{4-[2-(トリフェニル-λ5-ホスファニリデン)アセチル]フェニル}エチニル)ベンゾニトリル
  • 4-(2-{4-[2-(triphenyl-λ5-phosphanylidene)acetyl]phenyl}ethynyl)benzonitrile
Other name (1)：
  • 4-[[4-[(Triphenylphosphoranylidene)acetyl]phenyl]ethynyl]benzonitrile
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