4-[4-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]butan-2-one

Systemtic Name: 4-[4-[[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]butan-2-one Openeye Name: 4-[4-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]butan-2-one CAS Name: 4-[4-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]-2-butanone IUPAC Name: 4-[4-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]butan-2-one Traditional Name: 4-[4-[[(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]phenyl]butan-2-one Formula: C25H23FO4 MolecularWeight: 406.446123

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCC2=C3C(=CC(=C2)F)CO[C@@H](O3)C4=CC=CC=C4

InChI

InChI=1S/C25H23FO4/c1-17(27)7-8-18-9-11-23(12-10-18)28-15-20-13-22(26)14-21-16-29-25(30-24(20)21)19-5-3-2-4-6-19/h2-6,9-14,25H,7-8,15-16H2,1H3/t25-/m0/s1