2-[3-(9-Chloro-3-Methyl-4-Oxo[1,2]Oxazolo[4,3-C]Quinolin-5(4H)-Yl)Phenyl]-N-(3,4,5-Trimethoxyphenyl)Acetamide

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Properties Simple | Detailed

Formula C28H24ClN3O6
IUPAC Name 2-[3-(9-chloro-3-methyl-4-oxo-[1,2]oxazolo[4,3-c]quinolin-5-yl)phenyl]-n-(3,4,5-trimethoxyphenyl)acetamide
Molecular Mass 533.960 g·mol−1
Heat of Formation -493.6 ± 16.7 kJ·mol−1
Dipole Moment 1.87 ± 1.08 D
Volume 593.4 Å 3
Surface Area 494.69 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[3-(9-chloro-3-methyl-4-oxo-5-isoxazolo[4,3-c]quinolinyl)phenyl]-n-(3,4,5-trimethoxyphenyl)acetamide
  • 2-[3-(9-chloro-3-methyl-4-oxo-[1,2]oxazolo[4,3-c]quinolin-5-yl)phenyl]-n-(3,4,5-trimethoxyphenyl)ethanamide
  • 2-[3-(9-chloro-3-methyl-4-oxo-isoxazolo[4,3-c]quinolin-5-yl)phenyl]-n-(3,4,5-trimethoxyphenyl)acetamide
  • 2-[3-(9-chloro-4-keto-3-methyl-isoxazolo[4,3-c]quinolin-5-yl)phenyl]-n-(3,4,5-trimethoxyphenyl)acetamide
InChIKey PBHNQPNTZGNYBI-UHFFFAOYSA-N
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Elements H C N O Cl