1-[3-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[3-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-4-methoxy-phenyl]ethanone CAS Name: 1-[3-[[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-4-methoxyphenyl]ethanone IUPAC Name: 1-[3-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-4-methoxyphenyl]ethanone Traditional Name: 1-[3-[[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-4-methoxy-phenyl]ethanone Formula: C25H23FO4S MolecularWeight: 438.511123

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

InChI

InChI=1S/C25H23FO4S/c1-16(27)18-8-9-23(28-2)20(10-18)14-31-15-21-12-22(26)11-19-13-29-25(30-24(19)21)17-6-4-3-5-7-17/h3-12,25H,13-15H2,1-2H3