5-pentyl-2-pyridin-2-yl-1H-pyrazol-3-one

Systemtic Name: 5-pentyl-2-pyridin-2-yl-1H-pyrazol-3-one Openeye Name: 5-pentyl-2-(2-pyridyl)-1H-pyrazol-3-one CAS Name: 5-pentyl-2-(2-pyridinyl)-1H-pyrazol-3-one IUPAC Name: 5-pentyl-2-pyridin-2-yl-1H-pyrazol-3-one Traditional Name: 5-amyl-2-(2-pyridyl)-3-pyrazolin-3-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)N(N1)C2=CC=CC=N2

Isomeric SMILES

CCCCCC1=CC(=O)N(N1)C2=CC=CC=N2

InChI

InChI=1S/C13H17N3O/c1-2-3-4-7-11-10-13(17)16(15-11)12-8-5-6-9-14-12/h5-6,8-10,15H,2-4,7H2,1H3