5-[2-methyl-1,3-bis(oxidanyl)propan-2-yl]-2-(4-methylphenyl)-4H-pyrazol-3-one

Systemtic Name: 5-[2-methyl-1,3-bis(oxidanyl)propan-2-yl]-2-(4-methylphenyl)-4H-pyrazol-3-one Openeye Name: 5-[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]-2-(p-tolyl)-4H-pyrazol-3-one CAS Name: 5-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(4-methylphenyl)-4H-pyrazol-3-one IUPAC Name: 5-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(4-methylphenyl)-4H-pyrazol-3-one Traditional Name: 5-(2-hydroxy-1-methyl-1-methylol-ethyl)-2-(p-tolyl)-2-pyrazolin-3-one Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(=N2)C(C)(CO)CO

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CC(=N2)C(C)(CO)CO

InChI

InChI=1S/C14H18N2O3/c1-10-3-5-11(6-4-10)16-13(19)7-12(15-16)14(2,8-17)9-18/h3-6,17-18H,7-9H2,1-2H3