3-[[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]pyridin-3-yl]heptoxy]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]pyridin-3-yl]heptoxy]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]-3-pyridyl]heptoxy]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]heptoxy]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]pyridin-3-yl]heptoxy]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[(1R)-1-[6-[4-(trifluoromethyl)phenyl]-3-pyridyl]heptoxy]benzoyl]amino]propionic acid Formula: C29H31F3N2O4 MolecularWeight: 528.56265

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC[C@H](C1=CN=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/C29H31F3N2O4/c1-2-3-4-5-6-26(38-24-14-9-21(10-15-24)28(37)33-18-17-27(35)36)22-11-16-25(34-19-22)20-7-12-23(13-8-20)29(30,31)32/h7-16,19,26H,2-6,17-18H2,1H3,(H,33,37)(H,35,36)/t26-/m1/s1