2-azanyl-3-[3-[6-(4-fluorophenyl)-4-phenyl-pyridin-2-yl]oxy-2-hexanoyl-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-[6-(4-fluorophenyl)-4-phenyl-pyridin-2-yl]oxy-2-hexanoyl-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[3-[[6-(4-fluorophenyl)-4-phenyl-2-pyridyl]oxy]-2-hexanoyl-4-hydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[3-[[6-(4-fluorophenyl)-4-phenyl-2-pyridinyl]oxy]-4-hydroxy-2-(1-oxohexyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-[6-(4-fluorophenyl)-4-phenylpyridin-2-yl]oxy-2-hexanoyl-4-hydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-[2-caproyl-3-[[6-(4-fluorophenyl)-4-phenyl-2-pyridyl]oxy]-4-hydroxy-phenyl]propionic acid Formula: C32H31FN2O5 MolecularWeight: 542.597343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(C=CC(=C1OC2=CC(=CC(=N2)C3=CC=C(C=C3)F)C4=CC=CC=C4)O)CC(C(=O)O)N

Isomeric SMILES

CCCCCC(=O)C1=C(C=CC(=C1OC2=CC(=CC(=N2)C3=CC=C(C=C3)F)C4=CC=CC=C4)O)CC(C(=O)O)N

InChI

InChI=1S/C32H31FN2O5/c1-2-3-5-10-27(36)30-22(17-25(34)32(38)39)13-16-28(37)31(30)40-29-19-23(20-8-6-4-7-9-20)18-26(35-29)21-11-14-24(33)15-12-21/h4,6-9,11-16,18-19,25,37H,2-3,5,10,17,34H2,1H3,(H,38,39)