Molecular Formula: C12H12N2O3
Natural Isotopic Abundance Mass: 232.23528
Mono-Isotopic Molecular Masses:
InChI string: InChI=1S/C12H12N2O3/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14/h4-6H,3H2,1-2H3,(H,16,17)
IUPAC: 1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid
BMRB Ligand Expo: NIXReference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)