sodium 5-butyl-5-ethyl-4,6-bis(oxidanylidene)-1-propyl-pyrimidin-2-olate

Systemtic Name: sodium 5-butyl-5-ethyl-4,6-bis(oxidanylidene)-1-propyl-pyrimidin-2-olate Openeye Name: sodium 5-butyl-5-ethyl-4,6-dioxo-1-propyl-pyrimidin-2-olate CAS Name: sodium 5-butyl-5-ethyl-4,6-dioxo-1-propyl-2-pyrimidinolate IUPAC Name: sodium 5-butyl-5-ethyl-4,6-dioxo-1-propylpyrimidin-2-olate Traditional Name: sodium 5-butyl-5-ethyl-4,6-diketo-1-propyl-pyrimidin-2-olate Formula: C13H21N2NaO3 MolecularWeight: 276.30721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N=C(N(C1=O)CCC)[O-])CC.[Na+]

Isomeric SMILES

CCCCC1(C(=O)N=C(N(C1=O)CCC)[O-])CC.[Na+]

InChI

InChI=1S/C13H22N2O3.Na/c1-4-7-8-13(6-3)10(16)14-12(18)15(9-5-2)11(13)17;/h4-9H2,1-3H3,(H,14,16,18);/q;+1/p-1