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

Systemtic Name: 3-phenyl-2-[[2-(phenylmethyl)-1-benzofuran-5-yl]methoxycarbonylamino]propanoic acid Openeye Name: 2-[(2-benzylbenzofuran-5-yl)methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[oxo-[[2-(phenylmethyl)-5-benzofuranyl]methoxy]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-benzyl-1-benzofuran-5-yl)methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[(2-benzylbenzofuran-5-yl)methoxycarbonylamino]-3-phenyl-propionic acid Formula: C26H23NO5 MolecularWeight: 429.46452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=C(O2)C=CC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(O2)C=CC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H23NO5/c28-25(29)23(15-19-9-5-2-6-10-19)27-26(30)31-17-20-11-12-24-21(13-20)16-22(32-24)14-18-7-3-1-4-8-18/h1-13,16,23H,14-15,17H2,(H,27,30)(H,28,29)