2-[2-[(3S)-3-[3-[(1E)-2-(7-Chloroquinolin-2-yl)ethenyl]phenyl]-3-chloropropyl]phenyl]-2-propanol

Analyte Name

2-[2-[(3S)-3-[3-[(1E)-2-(7-Chloroquinolin-2-yl)ethenyl]phenyl]-3-chloropropyl]phenyl]-2-propanol

CAS Number

880769-28-8

Molecular Formula

C29 H27 Cl2 N O

Molecular Weight

476.44

Accurate Mass

475.147

SMILES

CC(C)(O)c1ccccc1CC[C@H](Cl)c2cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c2

InChI

InChI=1S/C29H27Cl2NO/c1-29(2,33)26-9-4-3-7-21(26)13-17-27(31)23-8-5-6-20(18-23)10-15-25-16-12-22-11-14-24(30)19-28(22)32-25/h3-12,14-16,18-19,27,33H,13,17H2,1-2H3/b15-10+/t27-/m0/s1

IUPAC

2-[2-[(3S)-3-chloro-3-[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]propyl]phenyl]propan-2-ol

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Montelukast Sodium

Purity

>95% (HPLC)