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

Systemtic Name: sodium 2-phenyl-3-[2,4,6-tris(iodanyl)-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanoate Openeye Name: sodium 2-phenyl-3-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoate CAS Name: sodium 2-phenyl-3-[2,4,6-triiodo-3-(2-oxo-1-pyrrolidinyl)phenyl]propanoate IUPAC Name: sodium 2-phenyl-3-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoate Traditional Name: sodium 2-phenyl-3-[2,4,6-triiodo-3-(2-ketopyrrolidino)phenyl]propionate Formula: C19H15I3NNaO3 MolecularWeight: 709.03048

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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.[Na+]

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C(=C2I)CC(C3=CC=CC=C3)C(=O)[O-])I)I.[Na+]

InChI

InChI=1S/C19H16I3NO3.Na/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);/q;+1/p-1