sodium 5-ethyl-4,6-bis(oxidanylidene)-5-phenethyl-1H-pyrimidin-2-olate

Systemtic Name: sodium 5-ethyl-4,6-bis(oxidanylidene)-5-phenethyl-1H-pyrimidin-2-olate Openeye Name: sodium 5-ethyl-4,6-dioxo-5-phenethyl-1H-pyrimidin-2-olate CAS Name: sodium 5-ethyl-4,6-dioxo-5-phenethyl-1H-pyrimidin-2-olate IUPAC Name: sodium 5-ethyl-4,6-dioxo-5-phenethyl-1H-pyrimidin-2-olate Traditional Name: sodium 5-ethyl-4,6-diketo-5-phenethyl-1H-pyrimidin-2-olate Formula: C14H15N2NaO3 MolecularWeight: 282.27027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=NC1=O)[O-])CCC2=CC=CC=C2.[Na+]

Isomeric SMILES

CCC1(C(=O)NC(=NC1=O)[O-])CCC2=CC=CC=C2.[Na+]

InChI

InChI=1S/C14H16N2O3.Na/c1-2-14(9-8-10-6-4-3-5-7-10)11(17)15-13(19)16-12(14)18;/h3-7H,2,8-9H2,1H3,(H2,15,16,17,18,19);/q;+1/p-1