2-methyl-5-propyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one

Systemtic Name: 2-methyl-5-propyl-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one Openeye Name: 2-methyl-5-propyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one CAS Name: 2-methyl-4-[oxo(3-pyridinyl)methyl]-5-propyl-1H-pyrazol-3-one IUPAC Name: 2-methyl-5-propyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one Traditional Name: 2-methyl-4-nicotinoyl-5-propyl-3-pyrazolin-3-one Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N(N1)C)C(=O)C2=CN=CC=C2

Isomeric SMILES

CCCC1=C(C(=O)N(N1)C)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-3-5-10-11(13(18)16(2)15-10)12(17)9-6-4-7-14-8-9/h4,6-8,15H,3,5H2,1-2H3