[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]-(4-piperidin-1-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]-(4-piperidin-1-ylcarbonylpiperazin-1-yl)methanone Openeye Name: [4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone CAS Name: [4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]phenyl]-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]methanone IUPAC Name: [4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]phenyl]-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone Traditional Name: [4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]-[4-(piperidine-1-carbonyl)piperazino]methanone Formula: C23H30N6O4 MolecularWeight: 454.5221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)N4CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)N4CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H30N6O4/c1-17-21(29(32)33)18(2)28(24-17)16-19-6-8-20(9-7-19)22(30)25-12-14-27(15-13-25)23(31)26-10-4-3-5-11-26/h6-9H,3-5,10-16H2,1-2H3