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

Systemtic Name: 2-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 3-phenyl-2-[[5-(p-tolyl)benzofuran-2-yl]methoxycarbonylamino]propanoic acid CAS Name: 2-[[[5-(4-methylphenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 3-phenyl-2-[[5-(p-tolyl)benzofuran-2-yl]methoxycarbonylamino]propionic acid Formula: C26H23NO5 MolecularWeight: 429.46452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H23NO5/c1-17-7-9-19(10-8-17)20-11-12-24-21(14-20)15-22(32-24)16-31-26(30)27-23(25(28)29)13-18-5-3-2-4-6-18/h2-12,14-15,23H,13,16H2,1H3,(H,27,30)(H,28,29)