potassium; N-[3-(hydroxymethyl)phenyl]methanamide; 4-oxidanylideneazetidine-2-carboxylate

Systemtic Name: potassium; N-[3-(hydroxymethyl)phenyl]methanamide; 4-oxidanylideneazetidine-2-carboxylate Openeye Name: potassium; N-[3-(hydroxymethyl)phenyl]formamide; 4-oxoazetidine-2-carboxylate CAS Name: potassium; N-[3-(hydroxymethyl)phenyl]formamide; 4-oxo-2-azetidinecarboxylate IUPAC Name: potassium; N-[3-(hydroxymethyl)phenyl]formamide; 4-oxoazetidine-2-carboxylate Traditional Name: potassium; 4-ketoazetidine-2-carboxylate; N-(3-methylolphenyl)formamide Formula: C12H13KN2O5 MolecularWeight: 304.34032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC1=O)C(=O)[O-].C1=CC(=CC(=C1)NC=O)CO.[K+]

Isomeric SMILES

C1C(NC1=O)C(=O)[O-].C1=CC(=CC(=C1)NC=O)CO.[K+]

InChI

InChI=1S/C8H9NO2.C4H5NO3.K/c10-5-7-2-1-3-8(4-7)9-6-11;6-3-1-2(5-3)4(7)8;/h1-4,6,10H,5H2,(H,9,11);2H,1H2,(H,5,6)(H,7,8);/q;;+1/p-1