5-nitro-2-piperidin-1-yl-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide

Systemtic Name: 5-nitro-2-piperidin-1-yl-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Openeye Name: 5-nitro-2-(1-piperidyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide CAS Name: 5-nitro-N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]-2-(1-piperidinyl)benzamide IUPAC Name: 5-nitro-2-piperidin-1-yl-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Traditional Name: 5-nitro-2-piperidino-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Formula: C24H26N6O4 MolecularWeight: 462.50104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)N4C=CC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)N4C=CC=N4

InChI

InChI=1S/C24H26N6O4/c1-17(29-14-6-11-25-29)23(31)26-18-7-5-8-19(15-18)27-24(32)21-16-20(30(33)34)9-10-22(21)28-12-3-2-4-13-28/h5-11,14-17H,2-4,12-13H2,1H3,(H,26,31)(H,27,32)