1-[4-[1-(4-nitrophenyl)-5-propyl-pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-(4-nitrophenyl)-5-propyl-pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-(4-nitrophenyl)-5-propyl-pyrazole-4-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[1-(4-nitrophenyl)-5-propyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[1-(4-nitrophenyl)-5-propylpyrazole-4-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[1-(4-nitrophenyl)-5-propyl-pyrazole-4-carbonyl]piperazino]ethanone Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C19H23N5O4/c1-3-4-18-17(19(26)22-11-9-21(10-12-22)14(2)25)13-20-23(18)15-5-7-16(8-6-15)24(27)28/h5-8,13H,3-4,9-12H2,1-2H3