sodium 2-[[4-(iodanylmethyl)phenyl]carbonylamino]ethanesulfonate

Systemtic Name: sodium 2-[[4-(iodanylmethyl)phenyl]carbonylamino]ethanesulfonate Openeye Name: sodium 2-[[4-(iodomethyl)benzoyl]amino]ethanesulfonate CAS Name: sodium 2-[[[4-(iodomethyl)phenyl]-oxomethyl]amino]ethanesulfonate IUPAC Name: sodium 2-[[4-(iodomethyl)benzoyl]amino]ethanesulfonate Traditional Name: sodium 2-[[4-(iodomethyl)benzoyl]amino]ethanesulfonate Formula: C10H11INNaO4S MolecularWeight: 391.15788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CI)C(=O)NCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1CI)C(=O)NCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H12INO4S.Na/c11-7-8-1-3-9(4-2-8)10(13)12-5-6-17(14,15)16;/h1-4H,5-7H2,(H,12,13)(H,14,15,16);/q;+1/p-1