[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2-phenylsulfanylethanoate

Systemtic Name: [(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2-phenylsulfanylethanoate Openeye Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester IUPAC Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester Formula: C23H19FO4S MolecularWeight: 410.457963

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)CSC4=CC=CC=C4)F

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)COC(=O)CSC4=CC=CC=C4)F

InChI

InChI=1S/C23H19FO4S/c24-19-11-17(13-26-21(25)15-29-20-9-5-2-6-10-20)22-18(12-19)14-27-23(28-22)16-7-3-1-4-8-16/h1-12,23H,13-15H2/t23-/m0/s1