4-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-1-pyrazolyl]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[4-(5-fluoro-2-hydroxybenzoyl)pyrazol-1-yl]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-3-nitro-N-phenyl-benzenesulfonamide Formula: C22H15FN4O6S MolecularWeight: 482.441103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3C=C(C=N3)C(=O)C4=C(C=CC(=C4)F)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3C=C(C=N3)C(=O)C4=C(C=CC(=C4)F)O)[N+](=O)[O-]

InChI

InChI=1S/C22H15FN4O6S/c23-15-6-9-21(28)18(10-15)22(29)14-12-24-26(13-14)19-8-7-17(11-20(19)27(30)31)34(32,33)25-16-4-2-1-3-5-16/h1-13,25,28H