{4-[4-(Butylcarbamoyl)-2-{[(2,4-Dichlorophenyl)Sulfonyl]Amino}Phenoxy]-3-Methoxyphenyl}Acetic Acid

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Formula C26H26Cl2N2O7S
IUPAC Name 2-[4-[4-(butylcarbamoyl)-2-[(2,4-dichlorophenyl)sulfonylamino]phenoxy]-3-methoxy-phenyl]acetic acid
Molecular Mass 581.465 g·mol−1
Heat of Formation -1070.6 ± 16.7 kJ·mol−1
Dipole Moment 4.21 ± 1.08 D
Volume 647.37 Å 3
Surface Area 492.83 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.57 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[4-(butylamino-oxomethyl)-2-[(2,4-dichlorophenyl)sulfonylamino]phenoxy]-3-methoxyphenyl]acetic acid
  • 2-[4-[4-(butylcarbamoyl)-2-[(2,4-dichlorophenyl)sulfonylamino]phenoxy]-3-methoxy-phenyl]ethanoic acid
  • 2-[4-[4-(butylcarbamoyl)-2-[(2,4-dichlorophenyl)sulfonylamino]phenoxy]-3-methoxyphenyl]acetic acid
InChIKey DKSKRBVXRDGYAS-UHFFFAOYSA-N
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