3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]pentoxy]benzoyl]amino]propionic acid Formula: C28H28F3NO4 MolecularWeight: 499.52143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)OC3=CC=C(C=C3)C(=O)NCCC(=O)O

Isomeric SMILES

CCCCC(C1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)OC3=CC=C(C=C3)C(=O)NCCC(=O)O

InChI

InChI=1S/C28H28F3NO4/c1-2-3-4-25(36-24-15-11-22(12-16-24)27(35)32-18-17-26(33)34)21-7-5-19(6-8-21)20-9-13-23(14-10-20)28(29,30)31/h5-16,25H,2-4,17-18H2,1H3,(H,32,35)(H,33,34)