sodium 5-butan-2-yl-5-(2-methylprop-2-enyl)-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate

Systemtic Name: sodium 5-butan-2-yl-5-(2-methylprop-2-enyl)-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate Openeye Name: sodium 5-(2-methylallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate CAS Name: sodium 5-butan-2-yl-5-(2-methylprop-2-enyl)-4,6-dioxo-1H-pyrimidin-2-olate IUPAC Name: sodium 5-butan-2-yl-5-(2-methylprop-2-enyl)-4,6-dioxo-1H-pyrimidin-2-olate Traditional Name: sodium 4,6-diketo-5-(2-methylallyl)-5-sec-butyl-1H-pyrimidin-2-olate Formula: C12H17N2NaO3 MolecularWeight: 260.26475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3.Na/c1-5-8(4)12(6-7(2)3)9(15)13-11(17)14-10(12)16;/h8H,2,5-6H2,1,3-4H3,(H2,13,14,15,16,17);/q;+1/p-1