dipropan-2-yl 2-[3,5-diacetamido-2,4,6-tris(iodanyl)phenyl]carbonyloxypropanedioate

Systemtic Name: dipropan-2-yl 2-[3,5-diacetamido-2,4,6-tris(iodanyl)phenyl]carbonyloxypropanedioate Openeye Name: diisopropyl 2-(3,5-diacetamido-2,4,6-triiodo-benzoyl)oxypropanedioate CAS Name: 2-[(3,5-diacetamido-2,4,6-triiodophenyl)-oxomethoxy]propanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 2-(3,5-diacetamido-2,4,6-triiodobenzoyl)oxypropanedioate Traditional Name: 2-(3,5-diacetamido-2,4,6-triiodo-benzoyl)oxymalonic acid diisopropyl ester Formula: C20H23I3N2O8 MolecularWeight: 800.11863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C(=O)OC(C)C)OC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I

Isomeric SMILES

CC(C)OC(=O)C(C(=O)OC(C)C)OC(=O)C1=C(C(=C(C(=C1I)NC(=O)C)I)NC(=O)C)I

InChI

InChI=1S/C20H23I3N2O8/c1-7(2)31-19(29)17(20(30)32-8(3)4)33-18(28)11-12(21)15(24-9(5)26)14(23)16(13(11)22)25-10(6)27/h7-8,17H,1-6H3,(H,24,26)(H,25,27)