3-[[2-[4-(1-benzofuran-2-yl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propanoic acid

Systemtic Name: 3-[[2-[4-(1-benzofuran-2-yl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propanoic acid Openeye Name: 3-[[2-[4-(benzofuran-2-yl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propanoic acid CAS Name: 3-[[2-[4-(2-benzofuranyl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propanoic acid IUPAC Name: 3-[[2-[4-(1-benzofuran-2-yl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propanoic acid Traditional Name: 3-[[2-[4-(benzofuran-2-yl)-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-6-yl]methylamino]propionic acid Formula: C26H19F3N2O4 MolecularWeight: 480.43527

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C3=C(C=C(C=C3)C4=NC5=C(O4)C=C(C=C5)CNCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C3=C(C=C(C=C3)C4=NC5=C(O4)C=C(C=C5)CNCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C26H19F3N2O4/c27-26(28,29)19-12-17(6-7-18(19)22-13-16-3-1-2-4-21(16)34-22)25-31-20-8-5-15(11-23(20)35-25)14-30-10-9-24(32)33/h1-8,11-13,30H,9-10,14H2,(H,32,33)