2-[[5-iodanyl-2-(2-methoxyethoxymethoxy)phenyl]methyl]-3-[(4-pyridin-3-ylphenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[[5-iodanyl-2-(2-methoxyethoxymethoxy)phenyl]methyl]-3-[(4-pyridin-3-ylphenyl)carbonylamino]propanoic acid Openeye Name: 2-[[5-iodo-2-(2-methoxyethoxymethoxy)phenyl]methyl]-3-[[4-(3-pyridyl)benzoyl]amino]propanoic acid CAS Name: 2-[[5-iodo-2-(2-methoxyethoxymethoxy)phenyl]methyl]-3-[[oxo-[4-(3-pyridinyl)phenyl]methyl]amino]propanoic acid IUPAC Name: 2-[[5-iodo-2-(2-methoxyethoxymethoxy)phenyl]methyl]-3-[(4-pyridin-3-ylbenzoyl)amino]propanoic acid Traditional Name: 2-[5-iodo-2-(2-methoxyethoxymethoxy)benzyl]-3-[[4-(3-pyridyl)benzoyl]amino]propionic acid Formula: C26H27IN2O6 MolecularWeight: 590.40685

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC1=C(C=C(C=C1)I)CC(CNC(=O)C2=CC=C(C=C2)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

COCCOCOC1=C(C=C(C=C1)I)CC(CNC(=O)C2=CC=C(C=C2)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C26H27IN2O6/c1-33-11-12-34-17-35-24-9-8-23(27)14-21(24)13-22(26(31)32)16-29-25(30)19-6-4-18(5-7-19)20-3-2-10-28-15-20/h2-10,14-15,22H,11-13,16-17H2,1H3,(H,29,30)(H,31,32)