9-[2,4,6-tris(iodanyl)phenoxy]nonanoic acid

Systemtic Name: 9-[2,4,6-tris(iodanyl)phenoxy]nonanoic acid Openeye Name: 9-(2,4,6-triiodophenoxy)nonanoic acid CAS Name: 9-(2,4,6-triiodophenoxy)nonanoic acid IUPAC Name: 9-(2,4,6-triiodophenoxy)nonanoic acid Traditional Name: 9-(2,4,6-triiodophenoxy)pelargonic acid Formula: C15H19I3O3 MolecularWeight: 628.02297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)OCCCCCCCCC(=O)O)I)I

Isomeric SMILES

C1=C(C=C(C(=C1I)OCCCCCCCCC(=O)O)I)I

InChI

InChI=1S/C15H19I3O3/c16-11-9-12(17)15(13(18)10-11)21-8-6-4-2-1-3-5-7-14(19)20/h9-10H,1-8H2,(H,19,20)