Chem
J-GLOBAL ID：200907057174960013   Nikkaji number：J771.887J

1-[2-Oxo-2-(methylphenethylamino)ethyl]-5-(benzyloxy)-1H-indole-3-acetic acid

1-[2-オキソ-2-(メチルフェネチルアミノ)エチル]-5-(ベンジルオキシ)-1H-インドール-3-酢酸
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： C28H28N2O4
Molecular formula furigana： C28-H28-N2-O4
Molecular weight： 456.542
InChI： InChI=1S/C28H28N2O4/c1-29(15-14-21-8-4-2-5-9-21)27(31)19-30-18-23(16-28(32)33)25-17-24(12-13-26(25)30)34-20-22-10-6-3-7-11-22/h2-13,17-18H,14-16,19-20H2,1H3,(H,32,33)
InChI key： ZOTJAVXQUIZQEQ-UHFFFAOYSA-N
SMILES： CN(CCc1ccccc1)C(=O)Cn1cc(CC(=O)O)c2cc(OCc3ccccc3)ccc12
Systematic name  (3)：
  • 1-[2-オキソ-2-(メチルフェネチルアミノ)エチル]-5-(ベンジルオキシ)-1H-インドール-3-酢酸
  • 2-[5-(ベンジルオキシ)-1-{[メチル(2-フェニルエチル)カルバモイル]メチル}-1H-インドール-3-イル]酢酸
  • 2-[5-(benzyloxy)-1-{[methyl(2-phenylethyl)carbamoyl]methyl}-1H-indol-3-yl]acetic acid
Other name (1)：
  • 1-[2-Oxo-2-(methylphenethylamino)ethyl]-5-(benzyloxy)-1H-indole-3-acetic acid
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