5-propyl-2-pyridin-4-ylcarbonyl-4H-pyrazol-3-one

Systemtic Name: 5-propyl-2-pyridin-4-ylcarbonyl-4H-pyrazol-3-one Openeye Name: 5-propyl-2-(pyridine-4-carbonyl)-4H-pyrazol-3-one CAS Name: 2-[oxo(pyridin-4-yl)methyl]-5-propyl-4H-pyrazol-3-one IUPAC Name: 5-propyl-2-(pyridine-4-carbonyl)-4H-pyrazol-3-one Traditional Name: 2-isonicotinoyl-5-propyl-2-pyrazolin-3-one Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1)C(=O)C2=CC=NC=C2

Isomeric SMILES

CCCC1=NN(C(=O)C1)C(=O)C2=CC=NC=C2

InChI

InChI=1S/C12H13N3O2/c1-2-3-10-8-11(16)15(14-10)12(17)9-4-6-13-7-5-9/h4-7H,2-3,8H2,1H3