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

Systemtic Name: [3-(2-chlorophenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [3-(2-chlorophenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [3-(2-chlorophenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-(2-chlorophenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [3-(2-chlorophenyl)-1H-pyrazol-5-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C20H18ClN5O3 MolecularWeight: 411.84162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NN3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NN3)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H18ClN5O3/c21-17-4-2-1-3-16(17)18-13-19(23-22-18)20(27)25-11-9-24(10-12-25)14-5-7-15(8-6-14)26(28)29/h1-8,13H,9-12H2,(H,22,23)