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

Systemtic Name: 3-phenyl-2-[(5-pyridin-4-yl-1-benzofuran-2-yl)methoxycarbonylamino]propanoic acid Openeye Name: 3-phenyl-2-[[5-(4-pyridyl)benzofuran-2-yl]methoxycarbonylamino]propanoic acid CAS Name: 2-[[oxo-[(5-pyridin-4-yl-2-benzofuranyl)methoxy]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-2-[(5-pyridin-4-yl-1-benzofuran-2-yl)methoxycarbonylamino]propanoic acid Traditional Name: 3-phenyl-2-[[5-(4-pyridyl)benzofuran-2-yl]methoxycarbonylamino]propionic acid Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=CC=NC=C4

InChI

InChI=1S/C24H20N2O5/c27-23(28)21(12-16-4-2-1-3-5-16)26-24(29)30-15-20-14-19-13-18(6-7-22(19)31-20)17-8-10-25-11-9-17/h1-11,13-14,21H,12,15H2,(H,26,29)(H,27,28)