2-[(4-nitrophenyl)-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-methyl]sulfanylethanoate

Systemtic Name: 2-[(4-nitrophenyl)-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-methyl]sulfanylethanoate Openeye Name: 2-[(4-nitrophenyl)-(2-oxido-2-oxo-ethyl)sulfanyl-methyl]sulfanylacetate CAS Name: 2-[[(4-nitrophenyl)-[(2-oxido-2-oxoethyl)thio]methyl]thio]acetate IUPAC Name: 2-[(4-nitrophenyl)-(2-oxido-2-oxoethyl)sulfanylmethyl]sulfanylacetate Traditional Name: 2-[[[(2-keto-2-oxido-ethyl)thio]-(4-nitrophenyl)methyl]thio]acetate Formula: C11H9NO6S2-2 MolecularWeight: 315.32226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(SCC(=O)[O-])SCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(SCC(=O)[O-])SCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H11NO6S2/c13-9(14)5-19-11(20-6-10(15)16)7-1-3-8(4-2-7)12(17)18/h1-4,11H,5-6H2,(H,13,14)(H,15,16)/p-2