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

Systemtic Name: 4,4-bis(hydroxymethyl)-1-(4-methoxyphenyl)pyrazolidin-3-one Openeye Name: 4,4-bis(hydroxymethyl)-1-(4-methoxyphenyl)pyrazolidin-3-one CAS Name: 4,4-bis(hydroxymethyl)-1-(4-methoxyphenyl)-3-pyrazolidinone IUPAC Name: 4,4-bis(hydroxymethyl)-1-(4-methoxyphenyl)pyrazolidin-3-one Traditional Name: 1-(4-methoxyphenyl)-4,4-dimethylol-pyrazolidin-3-one Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(C(=O)N2)(CO)CO

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(C(=O)N2)(CO)CO

InChI

InChI=1S/C12H16N2O4/c1-18-10-4-2-9(3-5-10)14-6-12(7-15,8-16)11(17)13-14/h2-5,15-16H,6-8H2,1H3,(H,13,17)