2-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxycarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methoxycarbonylamino]-3-phenyl-propionic acid Formula: C24H19FN2O5 MolecularWeight: 434.416463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN2O5/c25-18-9-7-17(8-10-18)22-26-19-13-16(6-11-21(19)32-22)14-31-24(30)27-20(23(28)29)12-15-4-2-1-3-5-15/h1-11,13,20H,12,14H2,(H,27,30)(H,28,29)