2-[4-[1-(4-nitrophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[1-(4-nitrophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[1-(4-nitrophenyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazino]-1-piperidino-ethanone Formula: C21H26N6O4 MolecularWeight: 426.46894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H26N6O4/c28-20(24-8-2-1-3-9-24)16-23-10-12-25(13-11-23)21(29)17-14-22-26(15-17)18-4-6-19(7-5-18)27(30)31/h4-7,14-15H,1-3,8-13,16H2