N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanamide

Systemtic Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanamide Openeye Name: N-[1-(2,2-dimethylpropanoyl)-4-piperidyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide CAS Name: N-[1-(2,2-dimethyl-1-oxopropyl)-4-piperidinyl]-2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]acetamide IUPAC Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]acetamide Traditional Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-(1-pivaloyl-4-piperidyl)acetamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C27H31N5O4/c1-27(2,3)26(34)30-15-13-21(14-16-30)28-24(33)17-20-18-31(22-7-5-4-6-8-22)29-25(20)19-9-11-23(12-10-19)32(35)36/h4-12,18,21H,13-17H2,1-3H3,(H,28,33)