1-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-2-methyl-2-(4-nitropyrazol-1-yl)propan-1-one

Systemtic Name: 1-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-2-methyl-2-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 1-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]-2-methyl-2-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 1-[4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-2-methyl-2-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazin-1-yl]-2-methyl-2-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazino]-2-methyl-2-(4-nitropyrazol-1-yl)propan-1-one Formula: C18H27N7O3 MolecularWeight: 389.45208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C(C)(C)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C(C)(C)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H27N7O3/c1-5-23-12-15(14(2)20-23)11-21-6-8-22(9-7-21)17(26)18(3,4)24-13-16(10-19-24)25(27)28/h10,12-13H,5-9,11H2,1-4H3