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

Systemtic Name: sodium 2-[2-[3-(2-hydroxyethylcarbamoyl)-2,4,6-tris(iodanyl)phenoxy]phenyl]ethanoic acid Openeye Name: sodium 2-[2-[3-(2-hydroxyethylcarbamoyl)-2,4,6-triiodo-phenoxy]phenyl]acetic acid CAS Name: sodium 2-[2-[3-[(2-hydroxyethylamino)-oxomethyl]-2,4,6-triiodophenoxy]phenyl]acetic acid IUPAC Name: sodium 2-[2-[3-(2-hydroxyethylcarbamoyl)-2,4,6-triiodophenoxy]phenyl]acetic acid Traditional Name: sodium 2-[2-[3-(2-hydroxyethylcarbamoyl)-2,4,6-triiodo-phenoxy]phenyl]acetic acid Formula: C17H14I3NNaO5+ MolecularWeight: 715.99994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)O)OC2=C(C=C(C(=C2I)C(=O)NCCO)I)I.[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)O)OC2=C(C=C(C(=C2I)C(=O)NCCO)I)I.[Na+]

InChI

InChI=1S/C17H14I3NO5.Na/c18-10-8-11(19)16(15(20)14(10)17(25)21-5-6-22)26-12-4-2-1-3-9(12)7-13(23)24;/h1-4,8,22H,5-7H2,(H,21,25)(H,23,24);/q;+1