4-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]benzoate

Systemtic Name: 4-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]benzoate Openeye Name: 4-[(2-oxido-2-oxo-ethyl)sulfanylmethyl]benzoate CAS Name: 4-[[(2-oxido-2-oxoethyl)thio]methyl]benzoate IUPAC Name: 4-[(2-oxido-2-oxoethyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(2-keto-2-oxido-ethyl)thio]methyl]benzoate Formula: C10H8O4S-2 MolecularWeight: 224.23312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H10O4S/c11-9(12)6-15-5-7-1-3-8(4-2-7)10(13)14/h1-4H,5-6H2,(H,11,12)(H,13,14)/p-2