2-(hydroxymethyl)-2-methyl-1-phenyl-pyrazolidin-2-ium-3-one

Systemtic Name: 2-(hydroxymethyl)-2-methyl-1-phenyl-pyrazolidin-2-ium-3-one Openeye Name: 2-(hydroxymethyl)-2-methyl-1-phenyl-pyrazolidin-2-ium-3-one CAS Name: 2-(hydroxymethyl)-2-methyl-1-phenyl-3-pyrazolidin-2-iumone IUPAC Name: 2-(hydroxymethyl)-2-methyl-1-phenylpyrazolidin-2-ium-3-one Traditional Name: 2-methyl-2-methylol-1-phenyl-pyrazolidin-2-ium-3-one Formula: C11H15N2O2+ MolecularWeight: 207.249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CCN1C2=CC=CC=C2)CO

Isomeric SMILES

C[N+]1(C(=O)CCN1C2=CC=CC=C2)CO

InChI

InChI=1S/C11H15N2O2/c1-13(9-14)11(15)7-8-12(13)10-5-3-2-4-6-10/h2-6,14H,7-9H2,1H3/q+1