1-[5-ethyl-1-(4-nitrophenyl)pyrazol-3-yl]ethanone

Systemtic Name: 1-[5-ethyl-1-(4-nitrophenyl)pyrazol-3-yl]ethanone Openeye Name: 1-[5-ethyl-1-(4-nitrophenyl)pyrazol-3-yl]ethanone CAS Name: 1-[5-ethyl-1-(4-nitrophenyl)-3-pyrazolyl]ethanone IUPAC Name: 1-[5-ethyl-1-(4-nitrophenyl)pyrazol-3-yl]ethanone Traditional Name: 1-[5-ethyl-1-(4-nitrophenyl)pyrazol-3-yl]ethanone Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C13H13N3O3/c1-3-10-8-13(9(2)17)14-15(10)11-4-6-12(7-5-11)16(18)19/h4-8H,3H2,1-2H3