sodium 3-dodecanoyl-2,4,6-tris(iodanyl)benzoate

Systemtic Name: sodium 3-dodecanoyl-2,4,6-tris(iodanyl)benzoate Openeye Name: sodium 3-dodecanoyl-2,4,6-triiodo-benzoate CAS Name: sodium 2,4,6-triiodo-3-(1-oxododecyl)benzoate IUPAC Name: sodium 3-dodecanoyl-2,4,6-triiodobenzoate Traditional Name: sodium 2,4,6-triiodo-3-lauroyl-benzoate Formula: C19H24I3NaO3 MolecularWeight: 704.09524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25I3O3.Na/c1-2-3-4-5-6-7-8-9-10-11-15(23)16-13(20)12-14(21)17(18(16)22)19(24)25;/h12H,2-11H2,1H3,(H,24,25);/q;+1/p-1