Chem
J-GLOBAL ID：200907002768374794   Nikkaji number：J1.333.158H

3-Bromo-4-(nonyloxy)benzoic acid 4-[(4-cyanophenoxy)carbonyl]phenyl ester

3-ブロモ-4-(ノニルオキシ)安息香酸4-[(4-シアノフェノキシ)カルボニル]フェニル
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： C30H30BrNO5
Molecular formula furigana： C30-H30-BR-N-O5
Molecular weight： 564.476
InChI： InChI=1S/C30H30BrNO5/c1-2-3-4-5-6-7-8-19-35-28-18-13-24(20-27(28)31)30(34)37-26-16-11-23(12-17-26)29(33)36-25-14-9-22(21-32)10-15-25/h9-18,20H,2-8,19H2,1H3
InChI key： CAJILFPIVVBHNW-UHFFFAOYSA-N
SMILES： CCCCCCCCCOc1ccc(cc1Br)C(=O)Oc1ccc(cc1)C(=O)Oc1ccc(cc1)C#N
Systematic name  (3)：
  • 3-ブロモ-4-(ノニルオキシ)安息香酸4-[(4-シアノフェノキシ)カルボニル]フェニル
  • 4-[(4-シアノフェノキシ)カルボニル]フェニル 3-ブロモ-4-(ノニルオキシ)ベンゾアート
  • 4-[(4-cyanophenoxy)carbonyl]phenyl 3-bromo-4-(nonyloxy)benzoate
Other name (1)：
  • 3-Bromo-4-(nonyloxy)benzoic acid 4-[(4-cyanophenoxy)carbonyl]phenyl ester
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