2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[3-(2-oxidanylidenepiperidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[3-(2-oxidanylidenepiperidin-1-yl)phenyl]ethanamide Openeye Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[3-(2-oxo-1-piperidyl)phenyl]acetamide CAS Name: 2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-[3-(2-oxo-1-piperidinyl)phenyl]acetamide IUPAC Name: 2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide Traditional Name: N-[3-(2-ketopiperidino)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC(=CC=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC(=CC=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H25N5O4/c34-26(29-22-7-6-10-25(18-22)31-16-5-4-11-27(31)35)17-21-19-32(23-8-2-1-3-9-23)30-28(21)20-12-14-24(15-13-20)33(36)37/h1-3,6-10,12-15,18-19H,4-5,11,16-17H2,(H,29,34)