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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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