4,4-bis(hydroxymethyl)-1-(4-methylphenyl)pyrazolidin-3-one

Systemtic Name: 4,4-bis(hydroxymethyl)-1-(4-methylphenyl)pyrazolidin-3-one Openeye Name: 4,4-bis(hydroxymethyl)-1-(p-tolyl)pyrazolidin-3-one CAS Name: 4,4-bis(hydroxymethyl)-1-(4-methylphenyl)-3-pyrazolidinone IUPAC Name: 4,4-bis(hydroxymethyl)-1-(4-methylphenyl)pyrazolidin-3-one Traditional Name: 4,4-dimethylol-1-(p-tolyl)pyrazolidin-3-one Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(C(=O)N2)(CO)CO

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(C(=O)N2)(CO)CO

InChI

InChI=1S/C12H16N2O3/c1-9-2-4-10(5-3-9)14-6-12(7-15,8-16)11(17)13-14/h2-5,15-16H,6-8H2,1H3,(H,13,17)