2-Ethoxy-2-Oxoethyl [1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1H-Indol-3-Yl]Acetate

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Properties Simple | Detailed

Formula C23H22ClNO6
IUPAC Name (2-ethoxy-2-oxo-ethyl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-1-ium-2-ylium-3-yl]acetate
Molecular Mass 443.877 g·mol−1
Heat of Formation -866.0 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 507.19 Å 3
Surface Area 437.81 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.02 ± eV
Point Group Symmetry C1
Synonyms
  • (2-ethoxy-2-oxo-ethyl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetate
  • (2-ethoxy-2-oxo-ethyl) 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanoate
  • (2-ethoxy-2-oxoethyl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
  • 1h-indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-ethoxy-2-oxoethyl ester
  • 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetic acid (2-ethoxy-2-keto-ethyl) ester
  • 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]acetic acid (2-ethoxy-2-oxoethyl) ester
  • indomethacin eocme
  • indomethacin ethoxycarbonylmethyl ester
CAS Number(s)
  • 76812-43-6
InChIKey LJPQBEUXEDLQEJ-UHFFFAOYSA-N
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