4-fluoranyl-N-[1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-(3-nitro-4-pyrrolidin-1-yl-benzoyl)-4-piperidyl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-(3-nitro-4-pyrrolidin-1-ylbenzoyl)piperidin-4-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-(3-nitro-4-pyrrolidino-benzoyl)-4-piperidyl]benzenesulfonamide Formula: C22H25FN4O5S MolecularWeight: 476.521103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O5S/c23-17-4-6-19(7-5-17)33(31,32)24-18-9-13-26(14-10-18)22(28)16-3-8-20(21(15-16)27(29)30)25-11-1-2-12-25/h3-8,15,18,24H,1-2,9-14H2