sodium 5-butyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione

Systemtic Name: sodium 5-butyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione Openeye Name: sodium 5-butyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione CAS Name: sodium 5-butyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione IUPAC Name: sodium 5-butyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione Traditional Name: sodium 5-butyl-5-(1-methylbutyl)barbituric acid Formula: C13H22N2NaO3+ MolecularWeight: 277.31515

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)NC(=O)NC1=O)C(C)CCC.[Na+]

Isomeric SMILES

CCCCC1(C(=O)NC(=O)NC1=O)C(C)CCC.[Na+]

InChI

InChI=1S/C13H22N2O3.Na/c1-4-6-8-13(9(3)7-5-2)10(16)14-12(18)15-11(13)17;/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18);/q;+1