2,4,6-tris(iodanyl)-3-(2-methylpropanoylamino)benzoic acid

Systemtic Name: 2,4,6-tris(iodanyl)-3-(2-methylpropanoylamino)benzoic acid Openeye Name: 2,4,6-triiodo-3-(2-methylpropanoylamino)benzoic acid CAS Name: 2,4,6-triiodo-3-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 2,4,6-triiodo-3-(2-methylpropanoylamino)benzoic acid Traditional Name: 2,4,6-triiodo-3-(isobutyrylamino)benzoic acid Formula: C11H10I3NO3 MolecularWeight: 584.91541

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10I3NO3/c1-4(2)10(16)15-9-6(13)3-5(12)7(8(9)14)11(17)18/h3-4H,1-2H3,(H,15,16)(H,17,18)