Chem
J-GLOBAL ID:200907023464963022   Nikkaji number:J426.702H

2-Ethoxy-4-[[3-methyl-1-(2-piperidinophenyl)butyl]carbamoylmethyl]benzoic acid

2-エトキシ-4-[[3-メチル-1-(2-ピペリジノフェニル)ブチル]カルバモイルメチル]安息香酸
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: C27H36N2O4
Molecular formula furigana: C27-H36-N2-O4
Molecular weight: 452.595
InChI: InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)
InChI key: FAEKWTJYAYMJKF-UHFFFAOYSA-N
SMILES: CCOc1cc(CC(=O)NC(CC(C)C)c2ccccc2N2CCCCC2)ccc1C(=O)O
Systematic name  (3):
  • 2-エトキシ-4-[[3-メチル-1-(2-ピペリジノフェニル)ブチル]カルバモイルメチル]安息香酸
  • 2-エトキシ-4-[({3-メチル-1-[2-(ピペリジン-1-イル)フェニル]ブチル}カルバモイル)メチル]安息香酸
  • 2-ethoxy-4-[({3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl}carbamoyl)methyl]benzoic acid
Other name (1):
  • 2-Ethoxy-4-[[3-methyl-1-(2-piperidinophenyl)butyl]carbamoylmethyl]benzoic acid
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