1-phenyl-3-pyrazol-1-yl-butan-1-one

Systemtic Name: 1-phenyl-3-pyrazol-1-yl-butan-1-one Openeye Name: 1-phenyl-3-pyrazol-1-yl-butan-1-one CAS Name: 1-phenyl-3-(1-pyrazolyl)-1-butanone IUPAC Name: 1-phenyl-3-pyrazol-1-ylbutan-1-one Traditional Name: 1-phenyl-3-pyrazol-1-yl-butan-1-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=CC=C1)N2C=CC=N2

Isomeric SMILES

CC(CC(=O)C1=CC=CC=C1)N2C=CC=N2

InChI

InChI=1S/C13H14N2O/c1-11(15-9-5-8-14-15)10-13(16)12-6-3-2-4-7-12/h2-9,11H,10H2,1H3