Products 1100617-38-6

CAS 1100617-38-6 appears in our catalog under these names: Montelukast Lactone, Montelukast Impurity 17, (3S)-3-(3-((1E)-2-(7-Chloro-2-quinolinyl)ethenyl)phenyl)-4,5-dihydro-2-benzoxepin-1(3H)-one, >95% (HPLC). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 25mg.

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

(3S)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-4,5-dihydro-3H-2-benzoxepin-1-one (CAS 1100617-38-6) is a chemical compound with the molecular formula C27H20ClNO2 and a molecular weight of 425.9 g/mol. IUPAC name: (3S)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-4,5-dihydro-3H-2-benzoxepin-1-one. InChIKey: QARHRYVEXSEWAF-FQKQOIFNSA-N.

Identity
Molecular formulaC27H20ClNO2
Molecular weight425.9 g/mol
IUPAC name(3S)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-4,5-dihydro-3H-2-benzoxepin-1-one
InChIKeyQARHRYVEXSEWAF-FQKQOIFNSA-N
SMILESC1CC2=CC=CC=C2C(=O)O[C@@H]1C3=CC=CC(=C3)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4

Computed by PubChem (NCBI)