2-(4-ethyl-1,3-dipyridin-2-yl-pyrazol-1-ium-1-yl)ethanoate

Systemtic Name: 2-(4-ethyl-1,3-dipyridin-2-yl-pyrazol-1-ium-1-yl)ethanoate Openeye Name: 2-[4-ethyl-1,3-bis(2-pyridyl)pyrazol-1-ium-1-yl]acetate CAS Name: 2-[4-ethyl-1,3-bis(2-pyridinyl)-1-pyrazol-1-iumyl]acetate IUPAC Name: 2-(4-ethyl-1,3-dipyridin-2-ylpyrazol-1-ium-1-yl)acetate Traditional Name: 2-[4-ethyl-1,3-bis(2-pyridyl)pyrazol-1-ium-1-yl]acetate Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](N=C1C2=CC=CC=N2)(CC(=O)[O-])C3=CC=CC=N3

Isomeric SMILES

CCC1=C[N+](N=C1C2=CC=CC=N2)(CC(=O)[O-])C3=CC=CC=N3

InChI

InChI=1S/C17H16N4O2/c1-2-13-11-21(12-16(22)23,15-8-4-6-10-19-15)20-17(13)14-7-3-5-9-18-14/h3-11H,2,12H2,1H3