5-(hydroxymethyl)-1,4-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 5-(hydroxymethyl)-1,4-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 5-(hydroxymethyl)-1,4-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 5-(hydroxymethyl)-1,4-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 5-(hydroxymethyl)-1,4-dimethyl-2-phenylpyrazol-3-one Traditional Name: 1,4-dimethyl-5-methylol-2-phenyl-3-pyrazolin-3-one Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)CO

Isomeric SMILES

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)CO

InChI

InChI=1S/C12H14N2O2/c1-9-11(8-15)13(2)14(12(9)16)10-6-4-3-5-7-10/h3-7,15H,8H2,1-2H3