5-[2-azanyl-3-methyl-4,6-bis(oxidanylidene)-1H-pyrimidin-3-ium-5-yl]pentanoic acid

Systemtic Name: 5-[2-azanyl-3-methyl-4,6-bis(oxidanylidene)-1H-pyrimidin-3-ium-5-yl]pentanoic acid Openeye Name: 5-(2-amino-3-methyl-4,6-dioxo-1H-pyrimidin-3-ium-5-yl)pentanoic acid CAS Name: 5-(2-amino-3-methyl-4,6-dioxo-1H-pyrimidin-3-ium-5-yl)pentanoic acid IUPAC Name: 5-(2-amino-3-methyl-4,6-dioxo-1H-pyrimidin-3-ium-5-yl)pentanoic acid Traditional Name: 5-(2-amino-4,6-diketo-3-methyl-1H-pyrimidin-3-ium-5-yl)valeric acid Formula: C10H16N3O4+ MolecularWeight: 242.25174

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC(=O)C(C1=O)CCCCC(=O)O)N

Isomeric SMILES

C[N+]1=C(NC(=O)C(C1=O)CCCCC(=O)O)N

InChI

InChI=1S/C10H15N3O4/c1-13-9(17)6(8(16)12-10(13)11)4-2-3-5-7(14)15/h6H,2-5H2,1H3,(H3,11,12,14,15,16)/p+1