3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]butan-2-yloxy]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]butan-2-yloxy]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]propoxy]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]butan-2-yloxy]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]phenyl]butan-2-yloxy]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-[4-[4-(trifluoromethyl)phenyl]benzyl]propoxy]benzoyl]amino]propionic acid Formula: C27H26F3NO4 MolecularWeight: 485.49485

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=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

CCC(CC1=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/C27H26F3NO4/c1-2-23(35-24-13-9-21(10-14-24)26(34)31-16-15-25(32)33)17-18-3-5-19(6-4-18)20-7-11-22(12-8-20)27(28,29)30/h3-14,23H,2,15-17H2,1H3,(H,31,34)(H,32,33)