5-ethanoyl-3-hexyl-2,6-bis(oxidanylidene)pyrimidin-4-olate

Systemtic Name: 5-ethanoyl-3-hexyl-2,6-bis(oxidanylidene)pyrimidin-4-olate Openeye Name: 5-acetyl-3-hexyl-2,6-dioxo-pyrimidin-4-olate CAS Name: 5-acetyl-3-hexyl-2,6-dioxo-4-pyrimidinolate IUPAC Name: 5-acetyl-3-hexyl-2,6-dioxopyrimidin-4-olate Traditional Name: 5-acetyl-3-hexyl-2,6-diketo-pyrimidin-4-olate Formula: C12H17N2O4- MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C(=O)NC1=O)C(=O)C)[O-]

Isomeric SMILES

CCCCCCN1C(=C(C(=O)NC1=O)C(=O)C)[O-]

InChI

InChI=1S/C12H18N2O4/c1-3-4-5-6-7-14-11(17)9(8(2)15)10(16)13-12(14)18/h17H,3-7H2,1-2H3,(H,13,16,18)/p-1