2-[[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonylamino]ethanesulfonic acid

Systemtic Name: 2-[[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonylamino]ethanesulfonic acid Openeye Name: 2-[(4-hydroxy-3,5-diiodo-benzoyl)amino]ethanesulfonic acid CAS Name: 2-[[(4-hydroxy-3,5-diiodophenyl)-oxomethyl]amino]ethanesulfonic acid IUPAC Name: 2-[(4-hydroxy-3,5-diiodobenzoyl)amino]ethanesulfonic acid Traditional Name: 2-[(4-hydroxy-3,5-diiodo-benzoyl)amino]ethanesulfonic acid Formula: C9H9I2NO5S MolecularWeight: 497.0454

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)O)I)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1I)O)I)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C9H9I2NO5S/c10-6-3-5(4-7(11)8(6)13)9(14)12-1-2-18(15,16)17/h3-4,13H,1-2H2,(H,12,14)(H,15,16,17)