[4-acetyloxy-1-(2,6-dimethyl-1,3-dioxan-4-yl)-6-oxidanyl-octan-2-yl] 2,2-bis(bromanyl)-2-phenyl-ethanoate

Systemtic Name: [4-acetyloxy-1-(2,6-dimethyl-1,3-dioxan-4-yl)-6-oxidanyl-octan-2-yl] 2,2-bis(bromanyl)-2-phenyl-ethanoate Openeye Name: [3-acetoxy-1-[(2,6-dimethyl-1,3-dioxan-4-yl)methyl]-5-hydroxy-heptyl] 2,2-dibromo-2-phenyl-acetate CAS Name: 2,2-dibromo-2-phenylacetic acid [4-acetyloxy-1-(2,6-dimethyl-1,3-dioxan-4-yl)-6-hydroxyoctan-2-yl] ester IUPAC Name: [4-acetyloxy-1-(2,6-dimethyl-1,3-dioxan-4-yl)-6-hydroxyoctan-2-yl] 2,2-dibromo-2-phenylacetate Traditional Name: 2,2-dibromo-2-phenyl-acetic acid [3-acetoxy-1-[(2,6-dimethyl-1,3-dioxan-4-yl)methyl]-5-hydroxy-heptyl] ester Formula: C24H34Br2O7 MolecularWeight: 594.33056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(CC1CC(OC(O1)C)C)OC(=O)C(C2=CC=CC=C2)(Br)Br)OC(=O)C)O

Isomeric SMILES

CCC(CC(CC(CC1CC(OC(O1)C)C)OC(=O)C(C2=CC=CC=C2)(Br)Br)OC(=O)C)O

InChI

InChI=1S/C24H34Br2O7/c1-5-19(28)12-21(31-16(3)27)14-22(13-20-11-15(2)30-17(4)32-20)33-23(29)24(25,26)18-9-7-6-8-10-18/h6-10,15,17,19-22,28H,5,11-14H2,1-4H3