3-[2-[3-acetamido-2,4,6-tris(iodanyl)phenoxy]ethoxy]-2-methyl-propanoic acid

Systemtic Name: 3-[2-[3-acetamido-2,4,6-tris(iodanyl)phenoxy]ethoxy]-2-methyl-propanoic acid Openeye Name: 3-[2-(3-acetamido-2,4,6-triiodo-phenoxy)ethoxy]-2-methyl-propanoic acid CAS Name: 3-[2-(3-acetamido-2,4,6-triiodophenoxy)ethoxy]-2-methylpropanoic acid IUPAC Name: 3-[2-(3-acetamido-2,4,6-triiodophenoxy)ethoxy]-2-methylpropanoic acid Traditional Name: 3-[2-(3-acetamido-2,4,6-triiodo-phenoxy)ethoxy]-2-methyl-propionic acid Formula: C14H16I3NO5 MolecularWeight: 658.99395

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)O

Isomeric SMILES

CC(COCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)O

InChI

InChI=1S/C14H16I3NO5/c1-7(14(20)21)6-22-3-4-23-13-10(16)5-9(15)12(11(13)17)18-8(2)19/h5,7H,3-4,6H2,1-2H3,(H,18,19)(H,20,21)