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

Systemtic Name: [2-(4-chlorophenyl)-5-phenyl-pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [2-(4-chlorophenyl)-5-phenyl-pyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [2-(4-chlorophenyl)-5-phenyl-3-pyrazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [2-(4-chlorophenyl)-5-phenylpyrazol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [2-(4-chlorophenyl)-5-phenyl-pyrazol-3-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C26H22ClN5O3 MolecularWeight: 487.93758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NN3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NN3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H22ClN5O3/c27-20-6-8-22(9-7-20)31-25(18-24(28-31)19-4-2-1-3-5-19)26(33)30-16-14-29(15-17-30)21-10-12-23(13-11-21)32(34)35/h1-13,18H,14-17H2