PFAS
Global PFAS Screening Tool
No. of Substances: 18960
(3S,4R)-2-[(2-Chlorophenyl)thio]-8-(3-hydroxy-1-methyl-4-piperidinyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
CAS Number: 199589-10-1
IUPAC name: 2-(2-chlorophenyl)sulfanyl-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-5,7-dimethoxychromen-4-one
Molecular formula: C23H24ClNO5S
Molecular weight: 462.0
InChI: InChI=1S/C23H24ClNO5S/c1-25-9-8-13(16(27)12-25)21-17(28-2)11-18(29-3)22-15(26)10-20(30-23(21)22)31-19-7-5-4-6-14(19)24/h4-7,10-11,13,16,27H,8-9,12H2,1-3H3/t13-,16+/m0/s1
InChIKey: YQKNBDIFQSPZNN-XJKSGUPXSA-N
SMILES: CN1CC[C@@H]([C@@H](C1)O)C2=C(C=C(C3=C2OC(=CC3=O)SC4=CC=CC=C4Cl)OC)OC
EINECS: -
