sodium 2,4,6-tris(iodanyl)-3-(2-methoxyethanoylamino)-5-(methylcarbamoyl)benzoate

Systemtic Name: sodium 2,4,6-tris(iodanyl)-3-(2-methoxyethanoylamino)-5-(methylcarbamoyl)benzoate Openeye Name: sodium 2,4,6-triiodo-3-[(2-methoxyacetyl)amino]-5-(methylcarbamoyl)benzoate CAS Name: sodium 2,4,6-triiodo-3-[(2-methoxy-1-oxoethyl)amino]-5-(methylcarbamoyl)benzoate IUPAC Name: sodium 2,4,6-triiodo-3-[(2-methoxyacetyl)amino]-5-(methylcarbamoyl)benzoate Traditional Name: sodium 2,4,6-triiodo-3-[(2-methoxyacetyl)amino]-5-(methylcarbamoyl)benzoate Formula: C12H10I3N2NaO5 MolecularWeight: 665.92138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)COC)I)C(=O)[O-])I.[Na+]

Isomeric SMILES

CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)COC)I)C(=O)[O-])I.[Na+]

InChI

InChI=1S/C12H11I3N2O5.Na/c1-16-11(19)5-7(13)6(12(20)21)9(15)10(8(5)14)17-4(18)3-22-2;/h3H2,1-2H3,(H,16,19)(H,17,18)(H,20,21);/q;+1/p-1