1-(1-phenylpyrazol-4-yl)pentan-1-one

Systemtic Name: 1-(1-phenylpyrazol-4-yl)pentan-1-one Openeye Name: 1-(1-phenylpyrazol-4-yl)pentan-1-one CAS Name: 1-(1-phenyl-4-pyrazolyl)-1-pentanone IUPAC Name: 1-(1-phenylpyrazol-4-yl)pentan-1-one Traditional Name: 1-(1-phenylpyrazol-4-yl)pentan-1-one Formula: C14H16N2O MolecularWeight: 228.28964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O/c1-2-3-9-14(17)12-10-15-16(11-12)13-7-5-4-6-8-13/h4-8,10-11H,2-3,9H2,1H3