1,1,1-tris(fluoranyl)-N-[3-(3-nitro-2-oxidanyl-phenyl)phenyl]methanesulfonamide

Systemtic Name: 1,1,1-tris(fluoranyl)-N-[3-(3-nitro-2-oxidanyl-phenyl)phenyl]methanesulfonamide Openeye Name: 1,1,1-trifluoro-N-[3-(2-hydroxy-3-nitro-phenyl)phenyl]methanesulfonamide CAS Name: 1,1,1-trifluoro-N-[3-(2-hydroxy-3-nitrophenyl)phenyl]methanesulfonamide IUPAC Name: 1,1,1-trifluoro-N-[3-(2-hydroxy-3-nitrophenyl)phenyl]methanesulfonamide Traditional Name: 1,1,1-trifluoro-N-[3-(2-hydroxy-3-nitro-phenyl)phenyl]methanesulfonamide Formula: C13H9F3N2O5S MolecularWeight: 362.28117

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C(F)(F)F)C2=C(C(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C(F)(F)F)C2=C(C(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H9F3N2O5S/c14-13(15,16)24(22,23)17-9-4-1-3-8(7-9)10-5-2-6-11(12(10)19)18(20)21/h1-7,17,19H