sodium 2-[2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]ethoxy]-2-phenyl-ethanoate

Systemtic Name: sodium 2-[2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]ethoxy]-2-phenyl-ethanoate Openeye Name: sodium 2-[2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]ethoxy]-2-phenyl-acetate CAS Name: sodium 2-[2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]ethoxy]-2-phenylacetate IUPAC Name: sodium 2-[2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]ethoxy]-2-phenylacetate Traditional Name: sodium 2-[2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]ethoxy]-2-phenyl-acetate Formula: C20H19I3NNaO5 MolecularWeight: 757.07174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C(=C(C=C1I)I)OCCOC(C2=CC=CC=C2)C(=O)[O-])I)C(=O)C.[Na+]

Isomeric SMILES

CCN(C1=C(C(=C(C=C1I)I)OCCOC(C2=CC=CC=C2)C(=O)[O-])I)C(=O)C.[Na+]

InChI

InChI=1S/C20H20I3NO5.Na/c1-3-24(12(2)25)17-14(21)11-15(22)19(16(17)23)29-10-9-28-18(20(26)27)13-7-5-4-6-8-13;/h4-8,11,18H,3,9-10H2,1-2H3,(H,26,27);/q;+1/p-1