(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic 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 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C27H27FO7 MolecularWeight: 482.497483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=C3C(=CC(=C2)F)COC(O3)C4=CC=CC=C4

InChI

InChI=1S/C27H27FO7/c1-30-22-11-17(12-23(31-2)26(22)32-3)9-10-24(29)33-15-19-13-21(28)14-20-16-34-27(35-25(19)20)18-7-5-4-6-8-18/h4-8,11-14,27H,9-10,15-16H2,1-3H3