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Fig. 1 | Journal of Cheminformatics

Fig. 1

From: PubChem chemical structure standardization

Fig. 1

Exemplary drawings conventions for functional groups. a Examples taken from the IUPAC graphical representation standards for chemical structure diagrams concerning ionic bonds and salts and nitrogen compounds [7]. b Examples taken from the FDA substance registration system standard operating procedure substance definition manual. For nitro group and nitrogen oxides, both conventions agree on the preferred representation [8]

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