[2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]carbonyloxy]-3-carboxy-4-oxidanylidene-pentyl]-trimethyl-azanium

Systemtic Name: [2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]carbonyloxy]-3-carboxy-4-oxidanylidene-pentyl]-trimethyl-azanium Openeye Name: [3-carboxy-2-(2,4-dioxo-1H-pyrimidine-6-carbonyl)oxy-4-oxo-pentyl]-trimethyl-ammonium CAS Name: [3-carboxy-2-[(2,4-dioxo-1H-pyrimidin-6-yl)-oxomethoxy]-4-oxopentyl]-trimethylammonium IUPAC Name: [3-carboxy-2-(2,4-dioxo-1H-pyrimidine-6-carbonyl)oxy-4-oxopentyl]-trimethylazanium Traditional Name: [3-carboxy-2-(2,4-diketo-1H-pyrimidine-6-carbonyl)oxy-4-keto-pentyl]-trimethyl-ammonium Formula: C14H20N3O7+ MolecularWeight: 342.3245

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C[N+](C)(C)C)OC(=O)C1=CC(=O)NC(=O)N1)C(=O)O

Isomeric SMILES

CC(=O)C(C(C[N+](C)(C)C)OC(=O)C1=CC(=O)NC(=O)N1)C(=O)O

InChI

InChI=1S/C14H19N3O7/c1-7(18)11(12(20)21)9(6-17(2,3)4)24-13(22)8-5-10(19)16-14(23)15-8/h5,9,11H,6H2,1-4H3,(H2-,15,16,19,20,21,23)/p+1