potassium 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione hydrate

Systemtic Name: potassium 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione hydrate Openeye Name: potassium 5-ethyl-5-phenyl-hexahydropyrimidine-2,4,6-trione hydrate CAS Name: potassium 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione hydrate IUPAC Name: potassium 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione hydrate Traditional Name: potassium 5-ethyl-5-phenyl-barbituric acid hydrate Formula: C12H14KN2O4+ MolecularWeight: 289.34886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.O.[K+]

Isomeric SMILES

CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.O.[K+]

InChI

InChI=1S/C12H12N2O3.K.H2O/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16;;/h3-7H,2H2,1H3,(H2,13,14,15,16,17);;1H2/q;+1;