Products 213380-27-9

CAS 213380-27-9 is the registry number for Montelukast dicarboxylic acid. Offered by: Biosynth. Available pack sizes: 10mg, 5mg, 25mg, 50mg.

Structural formula: {0} (CAS {1})

2-[2-[(3R)-3-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]propyl]phenyl]-2-hydroxypropanoic acid (CAS 213380-27-9) is a chemical compound with the molecular formula C35H34ClNO5S and a molecular weight of 616.2 g/mol. IUPAC name: 2-[2-[(3R)-3-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]propyl]phenyl]-2-hydroxypropanoic acid. InChIKey: FJSYYPGNUBZDIM-VZLZVWCJSA-N.

Identity
Molecular formulaC35H34ClNO5S
Molecular weight616.2 g/mol
IUPAC name2-[2-[(3R)-3-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]propyl]phenyl]-2-hydroxypropanoic acid
InChIKeyFJSYYPGNUBZDIM-VZLZVWCJSA-N
SMILESCC(C1=CC=CC=C1CC[C@H](C2=CC=CC(=C2)/C=C/C3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)O)(C(=O)O)O

Computed by PubChem (NCBI)