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

Systemtic Name: 2-phenyl-2-[2,4,6-tris(iodanyl)-3-morpholin-4-ylcarbonyl-phenoxy]ethanoic acid Openeye Name: 2-phenyl-2-[2,4,6-triiodo-3-(morpholine-4-carbonyl)phenoxy]acetic acid CAS Name: 2-phenyl-2-[2,4,6-triiodo-3-[4-morpholinyl(oxo)methyl]phenoxy]acetic acid IUPAC Name: 2-phenyl-2-[2,4,6-triiodo-3-(morpholine-4-carbonyl)phenoxy]acetic acid Traditional Name: 2-phenyl-2-[2,4,6-triiodo-3-(morpholine-4-carbonyl)phenoxy]acetic acid Formula: C19H16I3NO5 MolecularWeight: 719.04745

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=C(C(=C(C=C2I)I)OC(C3=CC=CC=C3)C(=O)O)I

Isomeric SMILES

C1COCCN1C(=O)C2=C(C(=C(C=C2I)I)OC(C3=CC=CC=C3)C(=O)O)I

InChI

InChI=1S/C19H16I3NO5/c20-12-10-13(21)17(28-16(19(25)26)11-4-2-1-3-5-11)15(22)14(12)18(24)23-6-8-27-9-7-23/h1-5,10,16H,6-9H2,(H,25,26)