N-[1-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: N-[1-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperidin-4-yl]benzenesulfonamide Openeye Name: N-[1-(5-nitro-2-pyrrolidin-1-yl-benzoyl)-4-piperidyl]benzenesulfonamide CAS Name: N-[1-[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: N-[1-(5-nitro-2-pyrrolidin-1-ylbenzoyl)piperidin-4-yl]benzenesulfonamide Traditional Name: N-[1-(5-nitro-2-pyrrolidino-benzoyl)-4-piperidyl]benzenesulfonamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S/c27-22(20-16-18(26(28)29)8-9-21(20)24-12-4-5-13-24)25-14-10-17(11-15-25)23-32(30,31)19-6-2-1-3-7-19/h1-3,6-9,16-17,23H,4-5,10-15H2