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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O2/c1-2-4-10-7-11(16)15(14-10)12(17)9-5-3-6-13-8-9/h3,5-6,8H,2,4,7H2,1H3