4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[3,5-bis(trifluoromethyl)phenoxy]-N-methyl-3-nitro-benzenesulfonamide Formula: C15H10F6N2O5S MolecularWeight: 444.305719

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H10F6N2O5S/c1-22-29(26,27)11-2-3-13(12(7-11)23(24)25)28-10-5-8(14(16,17)18)4-9(6-10)15(19,20)21/h2-7,22H,1H3