(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: (6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 4-oxidanylidene-4-phenyl-butanoate Openeye Name: (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 4-oxo-4-phenyl-butanoate CAS Name: 4-oxo-4-phenylbutanoic acid (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 4-oxo-4-phenylbutanoate Traditional Name: 4-keto-4-phenyl-butyric acid (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C25H21FO5 MolecularWeight: 420.429643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21FO5/c26-21-13-19(15-29-23(28)12-11-22(27)17-7-3-1-4-8-17)24-20(14-21)16-30-25(31-24)18-9-5-2-6-10-18/h1-10,13-14,25H,11-12,15-16H2