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

Systemtic Name: 2-[3-[ethanoyl(methyl)amino]-2,4,6-tris(iodanyl)phenoxy]hexanoic acid Openeye Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodo-phenoxy]hexanoic acid CAS Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]hexanoic acid IUPAC Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]hexanoic acid Traditional Name: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodo-phenoxy]hexanoic acid Formula: C15H18I3NO4 MolecularWeight: 657.02113

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18I3NO4/c1-4-5-6-11(15(21)22)23-14-10(17)7-9(16)13(12(14)18)19(3)8(2)20/h7,11H,4-6H2,1-3H3,(H,21,22)