4-oxidanyl-3-phenyl-1-pyrazol-1-yl-butan-2-one

Systemtic Name: 4-oxidanyl-3-phenyl-1-pyrazol-1-yl-butan-2-one Openeye Name: 4-hydroxy-3-phenyl-1-pyrazol-1-yl-butan-2-one CAS Name: 4-hydroxy-3-phenyl-1-(1-pyrazolyl)-2-butanone IUPAC Name: 4-hydroxy-3-phenyl-1-pyrazol-1-ylbutan-2-one Traditional Name: 4-hydroxy-3-phenyl-1-pyrazol-1-yl-butan-2-one Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)C(=O)CN2C=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)C(CO)C(=O)CN2C=CC=N2

InChI

InChI=1S/C13H14N2O2/c16-10-12(11-5-2-1-3-6-11)13(17)9-15-8-4-7-14-15/h1-8,12,16H,9-10H2