5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)pyran-4-one

Systemtic Name: 5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)pyran-4-one Openeye Name: 5-[(2-chloro-6-fluoro-phenyl)methoxy]-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)pyran-4-one CAS Name: 5-[(2-chloro-6-fluorophenyl)methoxy]-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-pyranone IUPAC Name: 5-[(2-chloro-6-fluorophenyl)methoxy]-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)pyran-4-one Traditional Name: 5-(2-chloro-6-fluoro-benzyl)oxy-2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)pyran-4-one Formula: C22H19ClFNO3 MolecularWeight: 399.842563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC(=O)C(=CO3)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC(=O)C(=CO3)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H19ClFNO3/c23-19-6-3-7-20(24)18(19)13-28-22-14-27-17(10-21(22)26)12-25-9-8-15-4-1-2-5-16(15)11-25/h1-7,10,14H,8-9,11-13H2