3-[3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-1-phenyl-propyl]sulfanylpropanoate

Systemtic Name: 3-[3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-1-phenyl-propyl]sulfanylpropanoate Openeye Name: 3-[2-hydroxy-3-(2-oxido-2-oxo-ethyl)sulfanyl-1-phenyl-propyl]sulfanylpropanoate CAS Name: 3-[[2-hydroxy-3-[(2-oxido-2-oxoethyl)thio]-1-phenylpropyl]thio]propanoate IUPAC Name: 3-[2-hydroxy-3-(2-oxido-2-oxoethyl)sulfanyl-1-phenylpropyl]sulfanylpropanoate Traditional Name: 3-[[2-hydroxy-3-[(2-keto-2-oxido-ethyl)thio]-1-phenyl-propyl]thio]propionate Formula: C14H16O5S2-2 MolecularWeight: 328.40384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(CSCC(=O)[O-])O)SCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(CSCC(=O)[O-])O)SCCC(=O)[O-]

InChI

InChI=1S/C14H18O5S2/c15-11(8-20-9-13(18)19)14(21-7-6-12(16)17)10-4-2-1-3-5-10/h1-5,11,14-15H,6-9H2,(H,16,17)(H,18,19)/p-2