N-(2,5-dimethylphenyl)-4-fluoranyl-2-nitro-benzenesulfonamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-fluoranyl-2-nitro-benzenesulfonamide Openeye Name: N-(2,5-dimethylphenyl)-4-fluoro-2-nitro-benzenesulfonamide CAS Name: N-(2,5-dimethylphenyl)-4-fluoro-2-nitrobenzenesulfonamide IUPAC Name: N-(2,5-dimethylphenyl)-4-fluoro-2-nitrobenzenesulfonamide Traditional Name: N-(2,5-dimethylphenyl)-4-fluoro-2-nitro-benzenesulfonamide Formula: C14H13FN2O4S MolecularWeight: 324.327423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C14H13FN2O4S/c1-9-3-4-10(2)12(7-9)16-22(20,21)14-6-5-11(15)8-13(14)17(18)19/h3-8,16H,1-2H3