2-phenyl-1-pyrazol-1-yl-butan-1-one

Systemtic Name: 2-phenyl-1-pyrazol-1-yl-butan-1-one Openeye Name: 2-phenyl-1-pyrazol-1-yl-butan-1-one CAS Name: 2-phenyl-1-(1-pyrazolyl)-1-butanone IUPAC Name: 2-phenyl-1-pyrazol-1-ylbutan-1-one Traditional Name: 2-phenyl-1-pyrazol-1-yl-butan-1-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O/c1-2-12(11-7-4-3-5-8-11)13(16)15-10-6-9-14-15/h3-10,12H,2H2,1H3