4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(pyridin-2-ylmethyl)benzenesulfonamide

Systemtic Name: 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(pyridin-2-ylmethyl)benzenesulfonamide Openeye Name: 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(2-pyridylmethyl)benzenesulfonamide CAS Name: 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(2-pyridinylmethyl)benzenesulfonamide IUPAC Name: 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(pyridin-2-ylmethyl)benzenesulfonamide Traditional Name: 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-N-(2-pyridylmethyl)benzenesulfonamide Formula: C19H13F3N4O7S MolecularWeight: 498.38933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H13F3N4O7S/c20-19(21,22)12-9-16(25(27)28)18(17(10-12)26(29)30)33-14-4-6-15(7-5-14)34(31,32)24-11-13-3-1-2-8-23-13/h1-10,24H,11H2