N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H24N6O3 MolecularWeight: 420.46436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H24N6O3/c1-2-26-15-23-25-21(26)17-6-5-7-18(14-17)24-22(29)16-10-12-27(13-11-16)19-8-3-4-9-20(19)28(30)31/h3-9,14-16H,2,10-13H2,1H3,(H,24,29)