4-methoxy-3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzenesulfonamide

Systemtic Name: 4-methoxy-3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzenesulfonamide Openeye Name: 4-methoxy-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 4-methoxy-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 4-methoxy-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzenesulfonamide Formula: C15H13F3N2O5S2 MolecularWeight: 422.39933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2SCC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2SCC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H13F3N2O5S2/c1-25-13-7-6-10(8-12(13)20(21)22)27(23,24)19-11-4-2-3-5-14(11)26-9-15(16,17)18/h2-8,19H,9H2,1H3