1-[(5R)-3-methyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]propan-1-one

Systemtic Name: 1-[(5R)-3-methyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[(5R)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]propan-1-one CAS Name: 1-[(5R)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]-1-propanone IUPAC Name: 1-[(5R)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]propan-1-one Traditional Name: 1-[(5R)-5-hydroxy-3-methyl-5-phenyl-2-pyrazolin-1-yl]propan-1-one Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C)(C2=CC=CC=C2)O

Isomeric SMILES

CCC(=O)N1[C@@](CC(=N1)C)(C2=CC=CC=C2)O

InChI

InChI=1S/C13H16N2O2/c1-3-12(16)15-13(17,9-10(2)14-15)11-7-5-4-6-8-11/h4-8,17H,3,9H2,1-2H3/t13-/m1/s1