N-[4-[1-[3-(4-nitrophenoxy)propyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[1-[3-(4-nitrophenoxy)propyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[1-[3-(4-nitrophenoxy)propyl]piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[1-[3-(4-nitrophenoxy)propyl]-4-piperidinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[1-[3-(4-nitrophenoxy)propyl]piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-[1-[3-(4-nitrophenoxy)propyl]isonipecotoyl]phenyl]methanesulfonamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6S/c1-32(29,30)23-19-5-3-17(4-6-19)22(26)18-11-14-24(15-12-18)13-2-16-31-21-9-7-20(8-10-21)25(27)28/h3-10,18,23H,2,11-16H2,1H3