2-phenyl-3-[2,4,6-tris(iodanyl)-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanoic acid

Systemtic Name: 2-phenyl-3-[2,4,6-tris(iodanyl)-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanoic acid Openeye Name: 2-phenyl-3-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoic acid CAS Name: 2-phenyl-3-[2,4,6-triiodo-3-(2-oxo-1-pyrrolidinyl)phenyl]propanoic acid IUPAC Name: 2-phenyl-3-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoic acid Traditional Name: 2-phenyl-3-[2,4,6-triiodo-3-(2-ketopyrrolidino)phenyl]propionic acid Formula: C19H16I3NO3 MolecularWeight: 687.04865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C(=C2I)CC(C3=CC=CC=C3)C(=O)O)I)I

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C(=C2I)CC(C3=CC=CC=C3)C(=O)O)I)I

InChI

InChI=1S/C19H16I3NO3/c20-14-10-15(21)18(23-8-4-7-16(23)24)17(22)13(14)9-12(19(25)26)11-5-2-1-3-6-11/h1-3,5-6,10,12H,4,7-9H2,(H,25,26)