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

Systemtic Name: 2-phenyl-2-[2,4,6-tris(iodanyl)-3-(2-oxidanylidenemorpholin-4-yl)phenoxy]ethanoic acid Openeye Name: 2-phenyl-2-[2,4,6-triiodo-3-(2-oxomorpholin-4-yl)phenoxy]acetic acid CAS Name: 2-phenyl-2-[2,4,6-triiodo-3-(2-oxo-4-morpholinyl)phenoxy]acetic acid IUPAC Name: 2-phenyl-2-[2,4,6-triiodo-3-(2-oxomorpholin-4-yl)phenoxy]acetic acid Traditional Name: 2-phenyl-2-[2,4,6-triiodo-3-(2-ketomorpholino)phenoxy]acetic acid Formula: C18H14I3NO5 MolecularWeight: 705.02087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)CN1C2=C(C(=C(C=C2I)I)OC(C3=CC=CC=C3)C(=O)O)I

Isomeric SMILES

C1COC(=O)CN1C2=C(C(=C(C=C2I)I)OC(C3=CC=CC=C3)C(=O)O)I

InChI

InChI=1S/C18H14I3NO5/c19-11-8-12(20)17(14(21)15(11)22-6-7-26-13(23)9-22)27-16(18(24)25)10-4-2-1-3-5-10/h1-5,8,16H,6-7,9H2,(H,24,25)