2-[2-bromanyl-6-phenyl-4-[[6-phenyl-3-(trifluoromethyl)hexyl]carbamoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-bromanyl-6-phenyl-4-[[6-phenyl-3-(trifluoromethyl)hexyl]carbamoyl]phenoxy]ethanoic acid Openeye Name: 2-[2-bromo-6-phenyl-4-[[6-phenyl-3-(trifluoromethyl)hexyl]carbamoyl]phenoxy]acetic acid CAS Name: 2-[2-bromo-4-[oxo-[[6-phenyl-3-(trifluoromethyl)hexyl]amino]methyl]-6-phenylphenoxy]acetic acid IUPAC Name: 2-[2-bromo-6-phenyl-4-[[6-phenyl-3-(trifluoromethyl)hexyl]carbamoyl]phenoxy]acetic acid Traditional Name: 2-[2-bromo-6-phenyl-4-[[6-phenyl-3-(trifluoromethyl)hexyl]carbamoyl]phenoxy]acetic acid Formula: C28H27BrF3NO4 MolecularWeight: 578.41749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(CCNC(=O)C2=CC(=C(C(=C2)C3=CC=CC=C3)OCC(=O)O)Br)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCCC(CCNC(=O)C2=CC(=C(C(=C2)C3=CC=CC=C3)OCC(=O)O)Br)C(F)(F)F

InChI

InChI=1S/C28H27BrF3NO4/c29-24-17-21(16-23(20-11-5-2-6-12-20)26(24)37-18-25(34)35)27(36)33-15-14-22(28(30,31)32)13-7-10-19-8-3-1-4-9-19/h1-6,8-9,11-12,16-17,22H,7,10,13-15,18H2,(H,33,36)(H,34,35)