3-phenyl-4-propyl-1,4-dihydropyrazol-5-one

Systemtic Name: 3-phenyl-4-propyl-1,4-dihydropyrazol-5-one Openeye Name: 3-phenyl-4-propyl-1,4-dihydropyrazol-5-one CAS Name: 3-phenyl-4-propyl-1,4-dihydropyrazol-5-one IUPAC Name: 3-phenyl-4-propyl-1,4-dihydropyrazol-5-one Traditional Name: 5-phenyl-4-propyl-2-pyrazolin-3-one Formula: C12H14N2O MolecularWeight: 202.25236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=NNC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCC1C(=NNC1=O)C2=CC=CC=C2

InChI

InChI=1S/C12H14N2O/c1-2-6-10-11(13-14-12(10)15)9-7-4-3-5-8-9/h3-5,7-8,10H,2,6H2,1H3,(H,14,15)