(2-methyl-5-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (2-methyl-5-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (2-methyl-5-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (2-methyl-5-phenyl-3-pyrazolyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-methyl-5-phenylpyrazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2-methyl-5-phenyl-pyrazol-3-yl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O3/c1-23-20(15-19(22-23)16-5-3-2-4-6-16)21(27)25-13-11-24(12-14-25)17-7-9-18(10-8-17)26(28)29/h2-10,15H,11-14H2,1H3