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

Systemtic Name: N-(3,4-dimethoxyphenyl)-4-fluoranyl-2-nitro-benzenesulfonamide Openeye Name: N-(3,4-dimethoxyphenyl)-4-fluoro-2-nitro-benzenesulfonamide CAS Name: N-(3,4-dimethoxyphenyl)-4-fluoro-2-nitrobenzenesulfonamide IUPAC Name: N-(3,4-dimethoxyphenyl)-4-fluoro-2-nitrobenzenesulfonamide Traditional Name: N-(3,4-dimethoxyphenyl)-4-fluoro-2-nitro-benzenesulfonamide Formula: C14H13FN2O6S MolecularWeight: 356.326223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C14H13FN2O6S/c1-22-12-5-4-10(8-13(12)23-2)16-24(20,21)14-6-3-9(15)7-11(14)17(18)19/h3-8,16H,1-2H3