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

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-[2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]methanone Openeye Name: [2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-methylphenyl)-1-piperazinyl]-[2-(4-nitrophenyl)-5-phenyl-3-pyrazolyl]methanone IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-[2-(4-nitrophenyl)-5-phenylpyrazol-3-yl]methanone Traditional Name: [2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]-[4-(o-tolyl)piperazino]methanone Formula: C27H25N5O3 MolecularWeight: 467.5191

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O3/c1-20-7-5-6-10-25(20)29-15-17-30(18-16-29)27(33)26-19-24(21-8-3-2-4-9-21)28-31(26)22-11-13-23(14-12-22)32(34)35/h2-14,19H,15-18H2,1H3