lithium 5-carboxy-3-(4-methylphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate

Systemtic Name: lithium 5-carboxy-3-(4-methylphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate Openeye Name: lithium 5-carboxy-2,4-dioxo-3-(p-tolyl)-1H-pyrimidine-6-carboxylate CAS Name: lithium 5-carboxy-3-(4-methylphenyl)-2,4-dioxo-1H-pyrimidine-6-carboxylate IUPAC Name: lithium 5-carboxy-3-(4-methylphenyl)-2,4-dioxo-1H-pyrimidine-6-carboxylate Traditional Name: lithium 5-carboxy-2,4-diketo-3-(p-tolyl)-1H-pyrimidine-6-carboxylate Formula: C13H9LiN2O6 MolecularWeight: 296.16136

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=C(C=C1)N2C(=O)C(=C(NC2=O)C(=O)[O-])C(=O)O

Isomeric SMILES

[Li+].CC1=CC=C(C=C1)N2C(=O)C(=C(NC2=O)C(=O)[O-])C(=O)O

InChI

InChI=1S/C13H10N2O6.Li/c1-6-2-4-7(5-3-6)15-10(16)8(11(17)18)9(12(19)20)14-13(15)21;/h2-5H,1H3,(H,14,21)(H,17,18)(H,19,20);/q;+1/p-1