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

Systemtic Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-pyridin-4-yl-propanoic acid Openeye Name: 2-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]-3-(4-pyridyl)propanoic acid CAS Name: 2-[[[5-(4-fluorophenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]-3-pyridin-4-ylpropanoic acid IUPAC Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-pyridin-4-ylpropanoic acid Traditional Name: 2-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]-3-(4-pyridyl)propionic acid Formula: C24H19FN2O5 MolecularWeight: 434.416463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=NC=C4)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(C=C2)OC(=C3)COC(=O)NC(CC4=CC=NC=C4)C(=O)O)F

InChI

InChI=1S/C24H19FN2O5/c25-19-4-1-16(2-5-19)17-3-6-22-18(12-17)13-20(32-22)14-31-24(30)27-21(23(28)29)11-15-7-9-26-10-8-15/h1-10,12-13,21H,11,14H2,(H,27,30)(H,28,29)