sodium 5-ethanoyl-2,6-bis(oxidanylidene)-1-phenyl-3-prop-2-ynyl-pyrimidin-4-olate

Systemtic Name: sodium 5-ethanoyl-2,6-bis(oxidanylidene)-1-phenyl-3-prop-2-ynyl-pyrimidin-4-olate Openeye Name: sodium 5-acetyl-2,6-dioxo-1-phenyl-3-prop-2-ynyl-pyrimidin-4-olate CAS Name: sodium 5-acetyl-2,6-dioxo-1-phenyl-3-prop-2-ynyl-4-pyrimidinolate IUPAC Name: sodium 5-acetyl-2,6-dioxo-1-phenyl-3-prop-2-ynylpyrimidin-4-olate Traditional Name: sodium 5-acetyl-2,6-diketo-1-phenyl-3-propargyl-pyrimidin-4-olate Formula: C15H11N2NaO4 MolecularWeight: 306.24861

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=O)N(C1=O)C2=CC=CC=C2)CC#C)[O-].[Na+]

Isomeric SMILES

CC(=O)C1=C(N(C(=O)N(C1=O)C2=CC=CC=C2)CC#C)[O-].[Na+]

InChI

InChI=1S/C15H12N2O4.Na/c1-3-9-16-13(19)12(10(2)18)14(20)17(15(16)21)11-7-5-4-6-8-11;/h1,4-8,19H,9H2,2H3;/q;+1/p-1