N-(2-fluoranyl-5-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-fluoranyl-5-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(2-fluoro-5-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(2-fluoro-5-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(2-fluoro-5-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(2-fluoro-5-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C14H13FN2O4S MolecularWeight: 324.327423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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