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

Systemtic Name: sodium 2-[2,4,6-tris(iodanyl)-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanoate Openeye Name: sodium 2-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoate CAS Name: sodium 2-[2,4,6-triiodo-3-(2-oxo-1-pyrrolidinyl)phenyl]propanoate IUPAC Name: sodium 2-[2,4,6-triiodo-3-(2-oxopyrrolidin-1-yl)phenyl]propanoate Traditional Name: sodium 2-[2,4,6-triiodo-3-(2-ketopyrrolidino)phenyl]propionate Formula: C13H11I3NNaO3 MolecularWeight: 632.93452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C(C=C1I)I)N2CCCC2=O)I)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C1=C(C(=C(C=C1I)I)N2CCCC2=O)I)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H12I3NO3.Na/c1-6(13(19)20)10-7(14)5-8(15)12(11(10)16)17-4-2-3-9(17)18;/h5-6H,2-4H2,1H3,(H,19,20);/q;+1/p-1