(1S,2R,3S) Metconazole Carboxylic Acid
Product Code
TRC-M485620-25MG
Product Format
Neat
Molecular Formula
C17H20ClN3O3
Molecular Weight
349.82
Product Categories
Product Information
Chemical Data
Analyte Name
(1S,2R,3S) Metconazole Carboxylic Acid
Molecular Formula
C17H20ClN3O3
Molecular Weight
349.82
Accurate Mass
349.12
SMILES
O[C@]1([C@](C)(CC[C@H]1CC2=CC=C(Cl)C=C2)C(O)=O)CN3C=NC=N3
InChI
InChI=1S/C17H20ClN3O3/c1-16(15(22)23)7-6-13(8-12-2-4-14(18)5-3-12)17(16,24)9-21-11-19-10-20-21/h2-5,10-11,13,24H,6-9H2,1H3,(H,22,23)/t13-,16+,17+/m0/s1
IUPAC
(1S,2R,3S)-2-((1H-1,2,4-triazol-1-yl)methyl)-3-(4-chlorobenzyl)-2-hydroxy-1-methylcyclopentane-1-carboxylic acid
Product Data
Country of Origin
CANADA
Product Format
Neat