2-[1-(2-fluorophenyl)-2-nitro-ethyl]sulfanylethanoate

Systemtic Name: 2-[1-(2-fluorophenyl)-2-nitro-ethyl]sulfanylethanoate Openeye Name: 2-[1-(2-fluorophenyl)-2-nitro-ethyl]sulfanylacetate CAS Name: 2-[[1-(2-fluorophenyl)-2-nitroethyl]thio]acetate IUPAC Name: 2-[1-(2-fluorophenyl)-2-nitroethyl]sulfanylacetate Traditional Name: 2-[[1-(2-fluorophenyl)-2-nitro-ethyl]thio]acetate Formula: C10H9FNO4S- MolecularWeight: 258.246163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10FNO4S/c11-8-4-2-1-3-7(8)9(5-12(15)16)17-6-10(13)14/h1-4,9H,5-6H2,(H,13,14)/p-1