2-[3-acetamido-2,4,6-tris(iodanyl)phenyl]propanoic acid

Systemtic Name: 2-[3-acetamido-2,4,6-tris(iodanyl)phenyl]propanoic acid Openeye Name: 2-(3-acetamido-2,4,6-triiodo-phenyl)propanoic acid CAS Name: 2-(3-acetamido-2,4,6-triiodophenyl)propanoic acid IUPAC Name: 2-(3-acetamido-2,4,6-triiodophenyl)propanoic acid Traditional Name: 2-(3-acetamido-2,4,6-triiodo-phenyl)propionic acid Formula: C11H10I3NO3 MolecularWeight: 584.91541

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O

Isomeric SMILES

CC(C1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O

InChI

InChI=1S/C11H10I3NO3/c1-4(11(17)18)8-6(12)3-7(13)10(9(8)14)15-5(2)16/h3-4H,1-2H3,(H,15,16)(H,17,18)