4-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoyl]piperazin-2-one

Systemtic Name: 4-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanoyl]piperazin-2-one Openeye Name: 4-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]piperazin-2-one CAS Name: 4-[2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-1-oxoethyl]-2-piperazinone IUPAC Name: 4-[2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]acetyl]piperazin-2-one Traditional Name: 4-[2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetyl]piperazin-2-one Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O4/c27-19-14-24(11-10-22-19)20(28)12-16-13-25(17-4-2-1-3-5-17)23-21(16)15-6-8-18(9-7-15)26(29)30/h1-9,13H,10-12,14H2,(H,22,27)