2-nitro-N-(2-oxidanyl-3-piperidin-1-yl-propyl)-N-phenyl-benzenesulfonamide

Systemtic Name: 2-nitro-N-(2-oxidanyl-3-piperidin-1-yl-propyl)-N-phenyl-benzenesulfonamide Openeye Name: N-[2-hydroxy-3-(1-piperidyl)propyl]-2-nitro-N-phenyl-benzenesulfonamide CAS Name: N-[2-hydroxy-3-(1-piperidinyl)propyl]-2-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-(2-hydroxy-3-piperidin-1-ylpropyl)-2-nitro-N-phenylbenzenesulfonamide Traditional Name: N-(2-hydroxy-3-piperidino-propyl)-2-nitro-N-phenyl-benzenesulfonamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

C1CCN(CC1)CC(CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C20H25N3O5S/c24-18(15-21-13-7-2-8-14-21)16-22(17-9-3-1-4-10-17)29(27,28)20-12-6-5-11-19(20)23(25)26/h1,3-6,9-12,18,24H,2,7-8,13-16H2