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

Systemtic Name: 4-nitro-N-(2-oxidanyl-3-piperidin-1-yl-propyl)-N-phenyl-benzenesulfonamide Openeye Name: N-[2-hydroxy-3-(1-piperidyl)propyl]-4-nitro-N-phenyl-benzenesulfonamide CAS Name: N-[2-hydroxy-3-(1-piperidinyl)propyl]-4-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-(2-hydroxy-3-piperidin-1-ylpropyl)-4-nitro-N-phenylbenzenesulfonamide Traditional Name: N-(2-hydroxy-3-piperidino-propyl)-4-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=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

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

InChI

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