2-[[5-(4-methoxyphenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-(4-methoxyphenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[5-(4-methoxyphenyl)benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[5-(4-methoxyphenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[5-(4-methoxyphenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[5-(4-methoxyphenyl)benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propionic acid Formula: C26H23NO6 MolecularWeight: 445.46392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H23NO6/c1-31-21-10-7-18(8-11-21)19-9-12-24-20(14-19)15-22(33-24)16-32-26(30)27-23(25(28)29)13-17-5-3-2-4-6-17/h2-12,14-15,23H,13,16H2,1H3,(H,27,30)(H,28,29)