2-[2-bromanyl-6-(3-chloranyl-4-fluoranyl-phenyl)-4-(dodecylcarbamoyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-bromanyl-6-(3-chloranyl-4-fluoranyl-phenyl)-4-(dodecylcarbamoyl)phenoxy]ethanoic acid Openeye Name: 2-[2-bromo-6-(3-chloro-4-fluoro-phenyl)-4-(dodecylcarbamoyl)phenoxy]acetic acid CAS Name: 2-[2-bromo-6-(3-chloro-4-fluorophenyl)-4-[(dodecylamino)-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[2-bromo-6-(3-chloro-4-fluorophenyl)-4-(dodecylcarbamoyl)phenoxy]acetic acid Traditional Name: 2-[2-bromo-6-(3-chloro-4-fluoro-phenyl)-4-(laurylcarbamoyl)phenoxy]acetic acid Formula: C27H34BrClFNO4 MolecularWeight: 570.918563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C1=CC(=C(C(=C1)C2=CC(=C(C=C2)F)Cl)OCC(=O)O)Br

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C1=CC(=C(C(=C1)C2=CC(=C(C=C2)F)Cl)OCC(=O)O)Br

InChI

InChI=1S/C27H34BrClFNO4/c1-2-3-4-5-6-7-8-9-10-11-14-31-27(34)20-15-21(19-12-13-24(30)23(29)17-19)26(22(28)16-20)35-18-25(32)33/h12-13,15-17H,2-11,14,18H2,1H3,(H,31,34)(H,32,33)