Chem
J-GLOBAL ID:200907036527512403   Nikkaji number:J2.328.908C

4-Chloro-1H-indole-3-acetic acid (S)-1-methyl-2-oxo-2-butoxyethyl ester

4-クロロ-1H-インドール-3-酢酸(S)-1-メチル-2-オキソ-2-ブトキシエチル
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: C17H20ClNO4
Molecular formula furigana: C17-H20-CL-N-O4
Molecular weight: 337.800
InChI: InChI=1S/C17H20ClNO4/c1-3-4-8-22-17(21)11(2)23-15(20)9-12-10-19-14-7-5-6-13(18)16(12)14/h5-7,10-11,19H,3-4,8-9H2,1-2H3/t11-/m0/s1
InChI key: QIJGCYLFUGYEFA-NSHDSACASA-N
SMILES: CCCCOC(=O)[C@H](C)OC(=O)Cc1c[nH]c2cccc(Cl)c12
Systematic name  (3):
  • 4-クロロ-1H-インドール-3-酢酸(S)-1-メチル-2-オキソ-2-ブトキシエチル
  • ブチル (2S)-2-{[2-(4-クロロ-1H-インドール-3-イル)アセチル]オキシ}プロパノアート
  • butyl (2S)-2-{[2-(4-chloro-1H-indol-3-yl)acetyl]oxy}propanoate
Other name (1):
  • 4-Chloro-1H-indole-3-acetic acid (S)-1-methyl-2-oxo-2-butoxyethyl ester
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