5-[(dibutylazaniumyl)methyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate

Systemtic Name: 5-[(dibutylazaniumyl)methyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate Openeye Name: 5-[(dibutylammonio)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate CAS Name: 5-[(dibutylammonio)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate IUPAC Name: 5-[(dibutylazaniumyl)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate Traditional Name: 5-[(dibutylammonio)methyl]-2,4-diketo-1H-pyrimidine-6-carboxylate Formula: C14H23N3O4 MolecularWeight: 297.35012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(NC(=O)NC1=O)C(=O)[O-]

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(NC(=O)NC1=O)C(=O)[O-]

InChI

InChI=1S/C14H23N3O4/c1-3-5-7-17(8-6-4-2)9-10-11(13(19)20)15-14(21)16-12(10)18/h3-9H2,1-2H3,(H,19,20)(H2,15,16,18,21)