3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-(3-fluorobenzyl)piperazino]propan-1-one Formula: C19H24FN5O3 MolecularWeight: 389.423963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24FN5O3/c1-14-19(25(27)28)15(2)24(21-14)7-6-18(26)23-10-8-22(9-11-23)13-16-4-3-5-17(20)12-16/h3-5,12H,6-11,13H2,1-2H3