6-[[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenoxy]methyl]-2-methyl-isoquinolin-1-one

Systemtic Name: 6-[[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenoxy]methyl]-2-methyl-isoquinolin-1-one Openeye Name: 6-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenoxy]methyl]-2-methyl-isoquinolin-1-one CAS Name: 6-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenoxy]methyl]-2-methyl-1-isoquinolinone IUPAC Name: 6-[[3-fluoro-5-(4-methoxyoxan-4-yl)phenoxy]methyl]-2-methylisoquinolin-1-one Traditional Name: 6-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenoxy]methyl]-2-methyl-isocarbostyril Formula: C23H24FNO4 MolecularWeight: 397.439363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C(C1=O)C=CC(=C2)COC3=CC(=CC(=C3)C4(CCOCC4)OC)F

Isomeric SMILES

CN1C=CC2=C(C1=O)C=CC(=C2)COC3=CC(=CC(=C3)C4(CCOCC4)OC)F

InChI

InChI=1S/C23H24FNO4/c1-25-8-5-17-11-16(3-4-21(17)22(25)26)15-29-20-13-18(12-19(24)14-20)23(27-2)6-9-28-10-7-23/h3-5,8,11-14H,6-7,9-10,15H2,1-2H3