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

Systemtic Name: methyl 3,5-diacetamido-2,4,6-tris(iodanyl)benzoate Openeye Name: methyl 3,5-diacetamido-2,4,6-triiodo-benzoate CAS Name: 3,5-diacetamido-2,4,6-triiodobenzoic acid methyl ester IUPAC Name: methyl 3,5-diacetamido-2,4,6-triiodobenzoate Traditional Name: 3,5-diacetamido-2,4,6-triiodo-benzoic acid methyl ester Formula: C12H11I3N2O4 MolecularWeight: 627.94015

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11I3N2O4/c1-4(18)16-10-7(13)6(12(20)21-3)8(14)11(9(10)15)17-5(2)19/h1-3H3,(H,16,18)(H,17,19)