(2R)-3-(3-fluorophenyl)-2-[(5-phenyl-1-benzofuran-2-yl)methoxycarbonylamino]propanoic acid

Systemtic Name: (2R)-3-(3-fluorophenyl)-2-[(5-phenyl-1-benzofuran-2-yl)methoxycarbonylamino]propanoic acid Openeye Name: (2R)-3-(3-fluorophenyl)-2-[(5-phenylbenzofuran-2-yl)methoxycarbonylamino]propanoic acid CAS Name: (2R)-3-(3-fluorophenyl)-2-[[oxo-[(5-phenyl-2-benzofuranyl)methoxy]methyl]amino]propanoic acid IUPAC Name: (2R)-3-(3-fluorophenyl)-2-[(5-phenyl-1-benzofuran-2-yl)methoxycarbonylamino]propanoic acid Traditional Name: (2R)-3-(3-fluorophenyl)-2-[(5-phenylbenzofuran-2-yl)methoxycarbonylamino]propionic acid Formula: C25H20FNO5 MolecularWeight: 433.428403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC(=CC=C4)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)N[C@H](CC4=CC(=CC=C4)F)C(=O)O

InChI

InChI=1S/C25H20FNO5/c26-20-8-4-5-16(11-20)12-22(24(28)29)27-25(30)31-15-21-14-19-13-18(9-10-23(19)32-21)17-6-2-1-3-7-17/h1-11,13-14,22H,12,15H2,(H,27,30)(H,28,29)/t22-/m1/s1