5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione; 2-(trimethylazaniumyl)ethanoate Openeye Name: 5-ethyl-5-phenyl-hexahydropyrimidine-2,4,6-trione; 2-(trimethylammonio)acetate CAS Name: 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione; 2-(trimethylammonio)acetate IUPAC Name: 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione; 2-(trimethylazaniumyl)acetate Traditional Name: 5-ethyl-5-phenyl-barbituric acid; 2-(trimethylammonio)acetate Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O3.C5H11NO2/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16;1-6(2,3)4-5(7)8/h3-7H,2H2,1H3,(H2,13,14,15,16,17);4H2,1-3H3