[2,4-bis(iodanyl)-6-methylsulfonyl-phenyl] hexanoate

Systemtic Name: [2,4-bis(iodanyl)-6-methylsulfonyl-phenyl] hexanoate Openeye Name: (2,4-diiodo-6-methylsulfonyl-phenyl) hexanoate CAS Name: hexanoic acid (2,4-diiodo-6-methylsulfonylphenyl) ester IUPAC Name: (2,4-diiodo-6-methylsulfonylphenyl) hexanoate Traditional Name: hexanoic acid (2,4-diiodo-6-mesyl-phenyl) ester Formula: C13H16I2O4S MolecularWeight: 522.13768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(C=C(C=C1S(=O)(=O)C)I)I

Isomeric SMILES

CCCCCC(=O)OC1=C(C=C(C=C1S(=O)(=O)C)I)I

InChI

InChI=1S/C13H16I2O4S/c1-3-4-5-6-12(16)19-13-10(15)7-9(14)8-11(13)20(2,17)18/h7-8H,3-6H2,1-2H3