4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-piperidin-1-ylcarbonylphenyl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-piperidin-1-ylcarbonylphenyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-[oxo(1-piperidinyl)methyl]phenyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide Formula: C25H27N5O4 MolecularWeight: 461.51298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O4/c1-17-23(30(33)34)18(2)29(27-17)16-19-10-12-20(13-11-19)24(31)26-22-9-5-4-8-21(22)25(32)28-14-6-3-7-15-28/h4-5,8-13H,3,6-7,14-16H2,1-2H3,(H,26,31)