[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: [(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1,3-benzodioxole-5-carboxylate Openeye Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic 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 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester Formula: C23H17FO6 MolecularWeight: 408.375883

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)C4=CC5=C(C=C4)OCO5)F

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)COC(=O)C4=CC5=C(C=C4)OCO5)F

InChI

InChI=1S/C23H17FO6/c24-18-8-16(11-26-22(25)15-6-7-19-20(10-15)29-13-28-19)21-17(9-18)12-27-23(30-21)14-4-2-1-3-5-14/h1-10,23H,11-13H2/t23-/m0/s1