7-(2,6-Dichloro-4-{[(2-Chlorobenzoyl)Carbamoyl]Amino}Phenoxy)Heptanoic Acid

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Properties Simple | Detailed

Formula C21H21Cl3N2O5
IUPAC Name 7-[2,6-dichloro-4-[(2-chlorobenzoyl)carbamoylamino]phenoxy]heptanoic acid
Molecular Mass 487.761 g·mol−1
Heat of Formation -882.9 ± 16.7 kJ·mol−1
Dipole Moment 7.67 ± 1.08 D
Volume 530.0 Å 3
Surface Area 478.05 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 1.90 ± eV
Point Group Symmetry C1
Synonyms
  • 7-[2,6-dichloro-4-({[(2-chlorobenzoyl)amino]carbonyl}amino)phenoxy]heptanoic acid
  • 7-[2,6-dichloro-4-[(2-chlorobenzoyl)carbamoylamino]phenoxy]enanthic acid
  • 7-[2,6-dichloro-4-[(2-chlorophenyl)carbonylcarbamoylamino]phenoxy]heptanoic acid
  • 7-[2,6-dichloro-4-[[[[(2-chlorophenyl)-oxomethyl]amino]-oxomethyl]amino]phenoxy]heptanoic acid
  • 7-{2,6-dichloro-4-[3-(2-chloro-benzoyl)-ureido]-phenoxy}-heptanoic acid
  • bn2
InChIKey XQTOWNDCHQJXOQ-UHFFFAOYSA-N
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Elements H C N O Cl