heptoxymethyl 3-acetamido-2,4,6-tris(iodanyl)benzoate

Systemtic Name: heptoxymethyl 3-acetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: heptoxymethyl 3-acetamido-2,4,6-triiodo-benzoate CAS Name: 3-acetamido-2,4,6-triiodobenzoic acid heptoxymethyl ester IUPAC Name: heptoxymethyl 3-acetamido-2,4,6-triiodobenzoate Traditional Name: 3-acetamido-2,4,6-triiodo-benzoic acid heptoxymethyl ester Formula: C17H22I3NO4 MolecularWeight: 685.07429

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCOC(=O)C1=C(C(=C(C=C1I)I)NC(=O)C)I

Isomeric SMILES

CCCCCCCOCOC(=O)C1=C(C(=C(C=C1I)I)NC(=O)C)I

InChI

InChI=1S/C17H22I3NO4/c1-3-4-5-6-7-8-24-10-25-17(23)14-12(18)9-13(19)16(15(14)20)21-11(2)22/h9H,3-8,10H2,1-2H3,(H,21,22)