2-phenyl-2-[2,4,6-tris(iodanyl)-3-(propanoylamino)phenoxy]ethanoic acid

Systemtic Name: 2-phenyl-2-[2,4,6-tris(iodanyl)-3-(propanoylamino)phenoxy]ethanoic acid Openeye Name: 2-phenyl-2-[2,4,6-triiodo-3-(propanoylamino)phenoxy]acetic acid CAS Name: 2-phenyl-2-[2,4,6-triiodo-3-(1-oxopropylamino)phenoxy]acetic acid IUPAC Name: 2-phenyl-2-[2,4,6-triiodo-3-(propanoylamino)phenoxy]acetic acid Traditional Name: 2-phenyl-2-(2,4,6-triiodo-3-propionamido-phenoxy)acetic acid Formula: C17H14I3NO4 MolecularWeight: 677.01077

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14I3NO4/c1-2-12(22)21-14-10(18)8-11(19)16(13(14)20)25-15(17(23)24)9-6-4-3-5-7-9/h3-8,15H,2H2,1H3,(H,21,22)(H,23,24)