N-(2,3-dimethylphenyl)-4-fluoranyl-2-nitro-benzenesulfonamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-fluoranyl-2-nitro-benzenesulfonamide Openeye Name: N-(2,3-dimethylphenyl)-4-fluoro-2-nitro-benzenesulfonamide CAS Name: N-(2,3-dimethylphenyl)-4-fluoro-2-nitrobenzenesulfonamide IUPAC Name: N-(2,3-dimethylphenyl)-4-fluoro-2-nitrobenzenesulfonamide Traditional Name: N-(2,3-dimethylphenyl)-4-fluoro-2-nitro-benzenesulfonamide Formula: C14H13FN2O4S MolecularWeight: 324.327423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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