N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C13H10BrFN2O5S MolecularWeight: 405.196303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C13H10BrFN2O5S/c1-22-13-5-3-9(7-12(13)17(18)19)23(20,21)16-11-4-2-8(14)6-10(11)15/h2-7,16H,1H3