sodium 2-[[3,4-bis(iodanyl)phenyl]carbonylamino]ethanesulfonate

Systemtic Name: sodium 2-[[3,4-bis(iodanyl)phenyl]carbonylamino]ethanesulfonate Openeye Name: sodium 2-[(3,4-diiodobenzoyl)amino]ethanesulfonate CAS Name: sodium 2-[[(3,4-diiodophenyl)-oxomethyl]amino]ethanesulfonate IUPAC Name: sodium 2-[(3,4-diiodobenzoyl)amino]ethanesulfonate Traditional Name: sodium 2-[(3,4-diiodobenzoyl)amino]ethanesulfonate Formula: C9H8I2NNaO4S MolecularWeight: 503.02783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCS(=O)(=O)[O-])I)I.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCS(=O)(=O)[O-])I)I.[Na+]

InChI

InChI=1S/C9H9I2NO4S.Na/c10-7-2-1-6(5-8(7)11)9(13)12-3-4-17(14,15)16;/h1-2,5H,3-4H2,(H,12,13)(H,14,15,16);/q;+1/p-1