CAS 70585-35-2 Triadimenol isomer A - Analytical Products / Alfa Chemistry

CAT	APS70585352
CAS	70585-35-2
Structure
Synonyms	(αR,βS)-rel-β-(4-Chlorophenoxy)-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol, (1RS,2SR)-Triadimenol, Triadimenol A, erythro-Triadimenol, Triadimenol I, (R,S)-β-(4-Chlorophenoxy)-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol
IUPAC Name	(1S,2R)-1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol
Molecular Weight	295.76
Molecular Formula	C14H18ClN3O2
Canonical SMILES	CC(C)(C)[C@@H](O)[C@H](Oc1ccc(Cl)cc1)n2cncn2
InChI	InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3/t12-,13-/m0/s1

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