2,2,2-tris(fluoranyl)ethyl 2-(4-methylsulfanyl-2-nitro-phenyl)sulfinylethanoate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 2-(4-methylsulfanyl-2-nitro-phenyl)sulfinylethanoate Openeye Name: 2,2,2-trifluoroethyl 2-(4-methylsulfanyl-2-nitro-phenyl)sulfinylacetate CAS Name: 2-[4-(methylthio)-2-nitrophenyl]sulfinylacetic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 2-(4-methylsulfanyl-2-nitrophenyl)sulfinylacetate Traditional Name: 2-[4-(methylthio)-2-nitro-phenyl]sulfinylacetic acid 2,2,2-trifluoroethyl ester Formula: C11H10F3NO5S2 MolecularWeight: 357.32601

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)S(=O)CC(=O)OCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC(=C(C=C1)S(=O)CC(=O)OCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H10F3NO5S2/c1-21-7-2-3-9(8(4-7)15(17)18)22(19)5-10(16)20-6-11(12,13)14/h2-4H,5-6H2,1H3