N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[3-(tert-butylsulfamoyl)phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O5S/c1-22(2,3)24-32(30,31)18-8-6-7-17(15-18)23-21(27)16-11-13-25(14-12-16)19-9-4-5-10-20(19)26(28)29/h4-10,15-16,24H,11-14H2,1-3H3,(H,23,27)