2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]hexanoic acid

Systemtic Name: 2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]hexanoic acid Openeye Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]hexanoic acid CAS Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]hexanoic acid IUPAC Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]hexanoic acid Traditional Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]hexanoic acid Formula: C16H20I3NO4 MolecularWeight: 671.04771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)OC1=C(C=C(C(=C1I)N(CC)C(=O)C)I)I

Isomeric SMILES

CCCCC(C(=O)O)OC1=C(C=C(C(=C1I)N(CC)C(=O)C)I)I

InChI

InChI=1S/C16H20I3NO4/c1-4-6-7-12(16(22)23)24-15-11(18)8-10(17)14(13(15)19)20(5-2)9(3)21/h8,12H,4-7H2,1-3H3,(H,22,23)