3-(4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propanoate

Systemtic Name: 3-(4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propanoate Openeye Name: 3-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propanoate CAS Name: 3-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propanoate IUPAC Name: 3-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propanoate Traditional Name: 3-(4-hydroxy-2-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)propionate Formula: C11H10N2O4 MolecularWeight: 234.2081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC(=O)C(=C2O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC(=O)C(=C2O)CCC(=O)[O-]

InChI

InChI=1S/C11H10N2O4/c14-9(15)5-4-7-10(16)12-8-3-1-2-6-13(8)11(7)17/h1-3,6H,4-5H2,(H2,14,15,16,17)