(2S)-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]-2-[2-[2,2,2-tris(fluoranyl)ethanoyl]pyrrol-1-yl]propanoic acid

Systemtic Name: (2S)-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]-2-[2-[2,2,2-tris(fluoranyl)ethanoyl]pyrrol-1-yl]propanoic acid Openeye Name: (2S)-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]-2-[2-(2,2,2-trifluoroacetyl)pyrrol-1-yl]propanoic acid CAS Name: (2S)-3-[4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]-2-[2-(2,2,2-trifluoro-1-oxoethyl)-1-pyrrolyl]propanoic acid IUPAC Name: (2S)-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]-2-[2-(2,2,2-trifluoroacetyl)pyrrol-1-yl]propanoic acid Traditional Name: (2S)-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]-2-[2-(2,2,2-trifluoroacetyl)pyrrol-1-yl]propionic acid Formula: C27H23F3N2O5 MolecularWeight: 512.47713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC=C(C=C3)CC(C(=O)O)N4C=CC=C4C(=O)C(F)(F)F

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC=C(C=C3)C[C@@H](C(=O)O)N4C=CC=C4C(=O)C(F)(F)F

InChI

InChI=1S/C27H23F3N2O5/c1-17-21(31-25(37-17)19-6-3-2-4-7-19)13-15-36-20-11-9-18(10-12-20)16-23(26(34)35)32-14-5-8-22(32)24(33)27(28,29)30/h2-12,14,23H,13,15-16H2,1H3,(H,34,35)/t23-/m0/s1