2,2,3,3-tetrakis(fluoranyl)propyl 2-(4-methylsulfanyl-2-nitro-phenoxy)ethanoate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl 2-(4-methylsulfanyl-2-nitro-phenoxy)ethanoate Openeye Name: 2,2,3,3-tetrafluoropropyl 2-(4-methylsulfanyl-2-nitro-phenoxy)acetate CAS Name: 2-[4-(methylthio)-2-nitrophenoxy]acetic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl 2-(4-methylsulfanyl-2-nitrophenoxy)acetate Traditional Name: 2-[4-(methylthio)-2-nitro-phenoxy]acetic acid 2,2,3,3-tetrafluoropropyl ester Formula: C12H11F4NO5S MolecularWeight: 357.278053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F4NO5S/c1-23-7-2-3-9(8(4-7)17(19)20)21-5-10(18)22-6-12(15,16)11(13)14/h2-4,11H,5-6H2,1H3