Code/trivial name (a)	IUPAC name/SMILES notation/InChiKey (b)	Structural formula (c)
Acetamiprid	(E)‐N1‐[(6‐chloro‐3‐pyridyl)methyl]‐N2‐cyano‐N1‐ methylacetamidine Clc1ccc(CN(C)C(\C)=N\C#N)cn1 WCXDHFDTOYPNIE‐RIYZIHGNSA‐N
N‐desmethyl‐acetamiprid (IM‐2‐1)	(E)‐N‐[(6‐chloro‐3‐pyridyl)methyl]‐N′‐cyanoacetamidine Clc1ccc(CNC(\C)=N\C#N)cn1 AYEAUPRZTZWBBF‐UHFFFAOYSA‐N AYEAUPRZTZWBBF‐UHFFFAOYSA‐N
IM‐1‐4	1‐(6‐chloro‐3‐pyridyl)‐N‐ methylmethanamine Clc1ccc(CNC)cn1 XALCOJXGWJXWBL‐UHFFFAOYSA‐N
IM‐1‐5	N‐[(6‐chloro‐3‐pyridyl)methyl]‐N‐methylacetamidine Clc1ccc(CN(C)C(C)=N)cn1 JHZWQGRBAHJYIZ‐UHFFFAOYSA‐N
6‐chloronicotinic acid (IC‐0)	6‐chloronicotinic acid OC(=O)c1cnc(Cl)cc1 UAWMVMPAYRWUFX‐UHFFFAOYSA‐N

IUPAC: International Union of Pure and Applied Chemistry; SMILES: simplified molecular‐input line‐entry system; InChiKey: International Chemical Identifier Key.

^(a)The metabolite name in bold is the name used in the conclusion.

^(b)ACD/Name 2020.2.1 ACD/Labs 2020 Release (File version N15E41, Build 116563, 15 June 2020).

^(c)ACD/ChemSketch 2020.2.1 ACD/Labs 2020 Release (File version C25H41, Build 121153, 22 March 2021).