2-[2,3,4-tris(iodanyl)phenyl]carbonyloxybutanoate

Systemtic Name: 2-[2,3,4-tris(iodanyl)phenyl]carbonyloxybutanoate Openeye Name: 2-(2,3,4-triiodobenzoyl)oxybutanoate CAS Name: 2-[oxo-(2,3,4-triiodophenyl)methoxy]butanoate IUPAC Name: 2-(2,3,4-triiodobenzoyl)oxybutanoate Traditional Name: 2-(2,3,4-triiodobenzoyl)oxybutyrate Formula: C11H8I3O4- MolecularWeight: 584.89223

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC(=O)C1=C(C(=C(C=C1)I)I)I

Isomeric SMILES

CCC(C(=O)[O-])OC(=O)C1=C(C(=C(C=C1)I)I)I

InChI

InChI=1S/C11H9I3O4/c1-2-7(10(15)16)18-11(17)5-3-4-6(12)9(14)8(5)13/h3-4,7H,2H2,1H3,(H,15,16)/p-1