sodium 2-[4-[2-(phenylsulfonylamino)ethylsulfanylmethyl]phenoxy]ethanoate

Systemtic Name: sodium 2-[4-[2-(phenylsulfonylamino)ethylsulfanylmethyl]phenoxy]ethanoate Openeye Name: sodium 2-[4-[2-(benzenesulfonamido)ethylsulfanylmethyl]phenoxy]acetate CAS Name: sodium 2-[4-[[2-(benzenesulfonamido)ethylthio]methyl]phenoxy]acetate IUPAC Name: sodium 2-[4-[2-(benzenesulfonamido)ethylsulfanylmethyl]phenoxy]acetate Traditional Name: sodium 2-[4-[[2-(benzenesulfonamido)ethylthio]methyl]phenoxy]acetate Formula: C17H18NNaO5S2 MolecularWeight: 403.44829

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCSCC2=CC=C(C=C2)OCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCSCC2=CC=C(C=C2)OCC(=O)[O-].[Na+]

InChI

InChI=1S/C17H19NO5S2.Na/c19-17(20)12-23-15-8-6-14(7-9-15)13-24-11-10-18-25(21,22)16-4-2-1-3-5-16;/h1-9,18H,10-13H2,(H,19,20);/q;+1/p-1