propan-2-yl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate

Systemtic Name: propan-2-yl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: isopropyl 3,5-diacetamido-2,4,6-triiodo-benzoate CAS Name: 3,5-diacetamido-2,4,6-triiodobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3,5-diacetamido-2,4,6-triiodobenzoate Traditional Name: 3,5-diacetamido-2,4,6-triiodo-benzoic acid isopropyl ester Formula: C14H15I3N2O4 MolecularWeight: 655.99331

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15I3N2O4/c1-5(2)23-14(22)8-9(15)12(18-6(3)20)11(17)13(10(8)16)19-7(4)21/h5H,1-4H3,(H,18,20)(H,19,21)