2-[(5-iodanyl-2-oxidanyl-phenyl)methyl]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 2-[(5-iodanyl-2-oxidanyl-phenyl)methyl]-3-pyridin-3-yl-propanoic acid Openeye Name: 2-[(2-hydroxy-5-iodo-phenyl)methyl]-3-(3-pyridyl)propanoic acid CAS Name: 2-[(2-hydroxy-5-iodophenyl)methyl]-3-(3-pyridinyl)propanoic acid IUPAC Name: 2-[(2-hydroxy-5-iodophenyl)methyl]-3-pyridin-3-ylpropanoic acid Traditional Name: 2-(2-hydroxy-5-iodo-benzyl)-3-(3-pyridyl)propionic acid Formula: C15H14INO3 MolecularWeight: 383.18103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(CC2=C(C=CC(=C2)I)O)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CC(CC2=C(C=CC(=C2)I)O)C(=O)O

InChI

InChI=1S/C15H14INO3/c16-13-3-4-14(18)11(8-13)7-12(15(19)20)6-10-2-1-5-17-9-10/h1-5,8-9,12,18H,6-7H2,(H,19,20)