2,5-dimethyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one

Systemtic Name: 2,5-dimethyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one Openeye Name: 2,5-dimethyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one CAS Name: 2,5-dimethyl-4-[oxo(3-pyridinyl)methyl]-1H-pyrazol-3-one IUPAC Name: 2,5-dimethyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one Traditional Name: 2,5-dimethyl-4-nicotinoyl-3-pyrazolin-3-one Formula: C11H11N3O2 MolecularWeight: 217.22394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C)C(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=C(C(=O)N(N1)C)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C11H11N3O2/c1-7-9(11(16)14(2)13-7)10(15)8-4-3-5-12-6-8/h3-6,13H,1-2H3