ethyl (4R,5S)-2-(bromomethyl)-2-methyl-5-pentyl-1,3-dioxolane-4-carboxylate

Systemtic Name: ethyl (4R,5S)-2-(bromomethyl)-2-methyl-5-pentyl-1,3-dioxolane-4-carboxylate Openeye Name: ethyl (4R,5S)-2-(bromomethyl)-2-methyl-5-pentyl-1,3-dioxolane-4-carboxylate CAS Name: (4R,5S)-2-(bromomethyl)-2-methyl-5-pentyl-1,3-dioxolane-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,5S)-2-(bromomethyl)-2-methyl-5-pentyl-1,3-dioxolane-4-carboxylate Traditional Name: (4R,5S)-5-amyl-2-(bromomethyl)-2-methyl-1,3-dioxolane-4-carboxylic acid ethyl ester Formula: C13H23BrO4 MolecularWeight: 323.22332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(OC(O1)(C)CBr)C(=O)OCC

Isomeric SMILES

CCCCC[C@H]1[C@@H](OC(O1)(C)CBr)C(=O)OCC

InChI

InChI=1S/C13H23BrO4/c1-4-6-7-8-10-11(12(15)16-5-2)18-13(3,9-14)17-10/h10-11H,4-9H2,1-3H3/t10-,11+,13?/m0/s1