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

Systemtic Name: 1,5-dimethyl-4-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-[[4-(4-nitrophenyl)piperazino]methyl]-2-phenyl-3-pyrazolin-3-one Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O3/c1-17-21(22(28)26(23(17)2)19-6-4-3-5-7-19)16-24-12-14-25(15-13-24)18-8-10-20(11-9-18)27(29)30/h3-11H,12-16H2,1-2H3