sodium; 5-ethyl-4,6-bis(oxidanylidene)-5-pentan-2-yl-1H-pyrimidin-2-olate; 1H-pyrazole

Systemtic Name: sodium; 5-ethyl-4,6-bis(oxidanylidene)-5-pentan-2-yl-1H-pyrimidin-2-olate; 1H-pyrazole Openeye Name: sodium; 5-ethyl-5-(1-methylbutyl)-4,6-dioxo-1H-pyrimidin-2-olate; 1H-pyrazole CAS Name: sodium; 5-ethyl-4,6-dioxo-5-pentan-2-yl-1H-pyrimidin-2-olate; 1H-pyrazole IUPAC Name: sodium; 5-ethyl-4,6-dioxo-5-pentan-2-yl-1H-pyrimidin-2-olate; 1H-pyrazole Traditional Name: sodium; 5-ethyl-4,6-diketo-5-(1-methylbutyl)-1H-pyrimidin-2-olate; 1H-pyrazole Formula: C14H21N4NaO3 MolecularWeight: 316.33131

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=NC1=O)[O-])CC.C1=CNN=C1.[Na+]

Isomeric SMILES

CCCC(C)C1(C(=O)NC(=NC1=O)[O-])CC.C1=CNN=C1.[Na+]

InChI

InChI=1S/C11H18N2O3.C3H4N2.Na/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;1-2-4-5-3-1;/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);1-3H,(H,4,5);/q;;+1/p-1