2-[3-acetamido-2,4,6-tris(iodanyl)phenoxy]-2-(4-iodophenyl)ethanoic acid

Systemtic Name: 2-[3-acetamido-2,4,6-tris(iodanyl)phenoxy]-2-(4-iodophenyl)ethanoic acid Openeye Name: 2-(3-acetamido-2,4,6-triiodo-phenoxy)-2-(4-iodophenyl)acetic acid CAS Name: 2-(3-acetamido-2,4,6-triiodophenoxy)-2-(4-iodophenyl)acetic acid IUPAC Name: 2-(3-acetamido-2,4,6-triiodophenoxy)-2-(4-iodophenyl)acetic acid Traditional Name: 2-(3-acetamido-2,4,6-triiodo-phenoxy)-2-(4-iodophenyl)acetic acid Formula: C16H11I4NO4 MolecularWeight: 788.88072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C=C1I)I)OC(C2=CC=C(C=C2)I)C(=O)O)I

Isomeric SMILES

CC(=O)NC1=C(C(=C(C=C1I)I)OC(C2=CC=C(C=C2)I)C(=O)O)I

InChI

InChI=1S/C16H11I4NO4/c1-7(22)21-13-10(18)6-11(19)15(12(13)20)25-14(16(23)24)8-2-4-9(17)5-3-8/h2-6,14H,1H3,(H,21,22)(H,23,24)