Code/trivial name a	IUPAC name/SMILES notation/InChiKey b	Structural formula c
Difenoconazole	3‐chloro‐4‐[(2RS,4RS;2RS,4SR)‐4‐methyl‐2‐(1H‐1,2,4‐triazol‐1‐ylmethyl)‐1,3‐dioxolan‐2‐yl]phenyl 4‐chlorophenyl ether Clc1ccc(cc1)Oc1ccc(c(Cl)c1)C1(Cn2ncnc2)OCC(C)O1 BQYJATMQXGBDHF‐UHFFFAOYSA‐N
CGA201278	1‐({(2S,4S)‐2‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐4‐methyl‐1,3‐dioxolan‐2‐yl}methyl)‐1H‐1,2,4‐triazole Clc1ccc(cc1)Oc1ccc(c(Cl)c1)[C@]1(Cn2ncnc2)OC[C@H](C)O1 BQYJATMQXGBDHF‐ORAYPTAESA‐N
CGA201275	1‐({(2S,4R)‐2‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐4‐methyl‐1,3‐dioxolan‐2‐yl}methyl)‐1H‐1,2,4‐triazole Clc1ccc(cc1)Oc1ccc(c(Cl)c1)[C@]1(Cn2ncnc2)OC[C@@H](C)O1 BQYJATMQXGBDHF‐BFUOFWGJSA‐N
CGA201276	1‐({(2R,4S)‐2‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐4‐methyl‐1,3‐dioxolan‐2‐yl}methyl)‐1H‐1,2,4‐triazole Clc1ccc(cc1)Oc1ccc(c(Cl)c1)[C@@]1(Cn2ncnc2)OC[C@H](C)O1 BQYJATMQXGBDHF‐DJJJIMSYSA‐N
CGA201277	1‐({(2R,4R)‐2‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐4‐methyl‐1,3‐dioxolan‐2‐yl}methyl)‐1H‐1,2,4‐triazole Clc1ccc(cc1)Oc1ccc(c(Cl)c1)[C@@]1(Cn2ncnc2)OC[C@@H](C)O1 BQYJATMQXGBDHF‐YJYMSZOUSA‐N
Difenoconazole alcohol	(1R)‐1‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐2‐(1H‐1,2,4‐triazol‐1‐yl)ethanol O[C@@H](Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1Cl NBYSKMWDHCZSIP‐INIZCTEOSA‐N
CGA205375	(1S)‐1‐[2‐chloro‐4‐(4‐chlorophenoxy)phenyl]‐2‐(1H‐1,2,4‐triazol‐1‐yl)ethanol O[C@H](Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1Cl NBYSKMWDHCZSIP‐MRXNPFEDSA‐N

^a The compound name in bold is the name used in the conclusion.

^b ACD/Name 2021.1.3 ACD/Labs 2021.1.3 (File Version N15E41, Build 123232, 7 July 2021).

^c ACD/ChemSketch 2021.1.3 ACD/Labs 2021.1.3 (File Version C25H41, Build 123835, 29 August 2021).