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sodium 5-ethyl-5-hexan-2-yl-1,3-diazinane-2,4,6-trione

sodium 5-ethyl-5-hexan-2-yl-1,3-diazinane-2,4,6-trione

Systemtic Name:sodium 5-ethyl-5-hexan-2-yl-1,3-diazinane-2,4,6-trione
Openeye Name:sodium 5-ethyl-5-(1-methylpentyl)hexahydropyrimidine-2,4,6-trione
CAS Name:sodium 5-ethyl-5-hexan-2-yl-1,3-diazinane-2,4,6-trione
IUPAC Name:sodium 5-ethyl-5-hexan-2-yl-1,3-diazinane-2,4,6-trione
Traditional Name:sodium 5-ethyl-5-(1-methylpentyl)barbituric acid
Formula: C12H20N2NaO3+
MolecularWeight: 263.28857
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1(C(=O)NC(=O)NC1=O)CC.[Na+]


Isomeric SMILES

CCCCC(C)C1(C(=O)NC(=O)NC1=O)CC.[Na+]


InChI

InChI=1S/C12H20N2O3.Na/c1-4-6-7-8(3)12(5-2)9(15)13-11(17)14-10(12)16;/h8H,4-7H2,1-3H3,(H2,13,14,15,16,17);/q;+1


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