(4-cyclohexylpiperazin-1-yl)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone Openeye Name: (4-cyclohexylpiperazin-1-yl)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone CAS Name: (4-cyclohexyl-1-piperazinyl)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone IUPAC Name: (4-cyclohexylpiperazin-1-yl)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone Traditional Name: (4-cyclohexylpiperazino)-[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O3/c26-20(24-12-10-23(11-13-24)16-4-2-1-3-5-16)18-14-21-22-19(18)15-6-8-17(9-7-15)25(27)28/h6-9,14,16H,1-5,10-13H2,(H,21,22)