sodium 5-(cyclohepten-1-yl)-5-ethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: sodium 5-(cyclohepten-1-yl)-5-ethyl-1,3-diazinane-2,4,6-trione Openeye Name: sodium 5-(cyclohepten-1-yl)-5-ethyl-hexahydropyrimidine-2,4,6-trione CAS Name: sodium 5-(1-cycloheptenyl)-5-ethyl-1,3-diazinane-2,4,6-trione IUPAC Name: sodium 5-(cyclohepten-1-yl)-5-ethyl-1,3-diazinane-2,4,6-trione Traditional Name: sodium 5-(cyclohepten-1-yl)-5-ethyl-barbituric acid Formula: C13H18N2NaO3+ MolecularWeight: 273.28339

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=O)NC1=O)C2=CCCCCC2.[Na+]

Isomeric SMILES

CCC1(C(=O)NC(=O)NC1=O)C2=CCCCCC2.[Na+]

InChI

InChI=1S/C13H18N2O3.Na/c1-2-13(9-7-5-3-4-6-8-9)10(16)14-12(18)15-11(13)17;/h7H,2-6,8H2,1H3,(H2,14,15,16,17,18);/q;+1