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

Systemtic Name: butoxymethyl 3-acetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: butoxymethyl 3-acetamido-2,4,6-triiodo-benzoate CAS Name: 3-acetamido-2,4,6-triiodobenzoic acid butoxymethyl ester IUPAC Name: butoxymethyl 3-acetamido-2,4,6-triiodobenzoate Traditional Name: 3-acetamido-2,4,6-triiodo-benzoic acid butoxymethyl ester Formula: C14H16I3NO4 MolecularWeight: 642.99455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16I3NO4/c1-3-4-5-21-7-22-14(20)11-9(15)6-10(16)13(12(11)17)18-8(2)19/h6H,3-5,7H2,1-2H3,(H,18,19)