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

Systemtic Name: sodium 2,4,6-tris(iodanyl)-3-(propanoylamino)benzoic acid Openeye Name: sodium 2,4,6-triiodo-3-(propanoylamino)benzoic acid CAS Name: sodium 2,4,6-triiodo-3-(1-oxopropylamino)benzoic acid IUPAC Name: sodium 2,4,6-triiodo-3-(propanoylamino)benzoic acid Traditional Name: sodium 2,4,6-triiodo-3-propionamido-benzoic acid Formula: C10H8I3NNaO3+ MolecularWeight: 593.8786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I.[Na+]

Isomeric SMILES

CCC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I.[Na+]

InChI

InChI=1S/C10H8I3NO3.Na/c1-2-6(15)14-9-5(12)3-4(11)7(8(9)13)10(16)17;/h3H,2H2,1H3,(H,14,15)(H,16,17);/q;+1