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

Systemtic Name: (4-methoxyphenyl) 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: (4-methoxyphenyl) 3,5-diacetamido-2,4,6-triiodo-benzoate CAS Name: 3,5-diacetamido-2,4,6-triiodobenzoic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3,5-diacetamido-2,4,6-triiodobenzoate Traditional Name: 3,5-diacetamido-2,4,6-triiodo-benzoic acid (4-methoxyphenyl) ester Formula: C18H15I3N2O5 MolecularWeight: 720.03551

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)OC2=CC=C(C=C2)OC)I)NC(=O)C)I

Isomeric SMILES

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)OC2=CC=C(C=C2)OC)I)NC(=O)C)I

InChI

InChI=1S/C18H15I3N2O5/c1-8(24)22-16-13(19)12(14(20)17(15(16)21)23-9(2)25)18(26)28-11-6-4-10(27-3)5-7-11/h4-7H,1-3H3,(H,22,24)(H,23,25)