1-(2-ethoxy-2-oxidanylidene-1-sulfosulfanyl-ethyl)-3-(trifluoromethyl)benzene

Systemtic Name: 1-(2-ethoxy-2-oxidanylidene-1-sulfosulfanyl-ethyl)-3-(trifluoromethyl)benzene Openeye Name: 1-(2-ethoxy-2-oxo-1-sulfosulfanyl-ethyl)-3-(trifluoromethyl)benzene CAS Name: 1-[2-ethoxy-2-oxo-1-(sulfothio)ethyl]-3-(trifluoromethyl)benzene IUPAC Name: 1-(2-ethoxy-2-oxo-1-sulfosulfanylethyl)-3-(trifluoromethyl)benzene Traditional Name: 1-[2-ethoxy-2-keto-1-(sulfothio)ethyl]-3-(trifluoromethyl)benzene Formula: C11H11F3O5S2 MolecularWeight: 344.32725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=CC=C1)C(F)(F)F)SS(=O)(=O)O

Isomeric SMILES

CCOC(=O)C(C1=CC(=CC=C1)C(F)(F)F)SS(=O)(=O)O

InChI

InChI=1S/C11H11F3O5S2/c1-2-19-10(15)9(20-21(16,17)18)7-4-3-5-8(6-7)11(12,13)14/h3-6,9H,2H2,1H3,(H,16,17,18)