1-(4-methylphenyl)sulfonyl-N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]piperidine-4-carboxamide Openeye Name: N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]piperidine-4-carboxamide Traditional Name: N-[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]-1-tosyl-isonipecotamide Formula: C21H21N5O6S MolecularWeight: 471.48634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O6S/c1-14-5-7-18(8-6-14)33(30,31)25-11-9-15(10-12-25)19(27)22-21-24-23-20(32-21)16-3-2-4-17(13-16)26(28)29/h2-8,13,15H,9-12H2,1H3,(H,22,24,27)