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

Systemtic Name: [(2S)-6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2,3-dihydro-1,4-dioxine-5-carboxylate Openeye Name: [(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2,3-dihydro-1,4-dioxine-5-carboxylate CAS Name: 2,3-dihydro-1,4-dioxin-5-carboxylic acid [(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester IUPAC Name: [(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 2,3-dihydro-1,4-dioxine-5-carboxylate Traditional Name: 2,3-dihydro-p-dioxin-5-carboxylic acid [(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester Formula: C20H17BrO6 MolecularWeight: 433.24938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(=CO1)C(=O)OCC2=C3C(=CC(=C2)Br)COC(O3)C4=CC=CC=C4

Isomeric SMILES

C1COC(=CO1)C(=O)OCC2=C3C(=CC(=C2)Br)CO[C@@H](O3)C4=CC=CC=C4

InChI

InChI=1S/C20H17BrO6/c21-16-8-14(10-25-19(22)17-12-23-6-7-24-17)18-15(9-16)11-26-20(27-18)13-4-2-1-3-5-13/h1-5,8-9,12,20H,6-7,10-11H2/t20-/m0/s1