ethyl 4-[3-fluoranyl-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carboxylate

Systemtic Name: ethyl 4-[3-fluoranyl-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carboxylate Openeye Name: ethyl 4-[3-fluoro-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]tetrahydropyran-4-carboxylate CAS Name: 4-[3-fluoro-5-[[4-(2-methyl-1-imidazolyl)phenyl]methoxy]phenyl]-4-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-fluoro-5-[[4-(2-methylimidazol-1-yl)phenyl]methoxy]phenyl]oxane-4-carboxylate Traditional Name: 4-[3-fluoro-5-[4-(2-methylimidazol-1-yl)benzyl]oxy-phenyl]tetrahydropyran-4-carboxylic acid ethyl ester Formula: C25H27FN2O4 MolecularWeight: 438.491283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCOCC1)C2=CC(=CC(=C2)F)OCC3=CC=C(C=C3)N4C=CN=C4C

Isomeric SMILES

CCOC(=O)C1(CCOCC1)C2=CC(=CC(=C2)F)OCC3=CC=C(C=C3)N4C=CN=C4C

InChI

InChI=1S/C25H27FN2O4/c1-3-31-24(29)25(8-12-30-13-9-25)20-14-21(26)16-23(15-20)32-17-19-4-6-22(7-5-19)28-11-10-27-18(28)2/h4-7,10-11,14-16H,3,8-9,12-13,17H2,1-2H3