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. 2021 Sep 7;19(9):e06830. doi: 10.2903/j.efsa.2021.6830
Code/trivial namea IUPAC name/SMILES notation/InChiKeyb Structural formulac
acetamiprid (E)‐N1‐[(6‐chloro‐3‐pyridyl)methyl]‐N2‐cyano‐N1‐ methylacetamidine
Clc1ccc(CN(C)C(\C)=N\C#N)cn1
WCXDHFDTOYPNIE‐RIYZIHGNSA‐N graphic file with name EFS2-19-e06830-g007.jpg
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 graphic file with name EFS2-19-e06830-g006.jpg
IM‐1‐4 1‐(6‐chloro‐3‐pyridyl)‐N‐
methylmethanamine
Clc1ccc(CNC)cn1
XALCOJXGWJXWBL‐UHFFFAOYSA‐N graphic file with name EFS2-19-e06830-g002.jpg
IM‐1‐5 N‐[(6‐chloro‐3‐pyridyl)methyl]‐N‐methylacetamidine
Clc1ccc(CN(C)C(C)=N)cn1
JHZWQGRBAHJYIZ‐UHFFFAOYSA‐N graphic file with name EFS2-19-e06830-g003.jpg
6‐chloronicotinic acid (IC‐0) 6‐chloronicotinic acid
OC(=O)c1cnc(Cl)cc1
UAWMVMPAYRWUFX‐UHFFFAOYSA‐N graphic file with name EFS2-19-e06830-g004.jpg

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).