[3-(acetyloxymethyl)-5-(bromomethyl)cyclohexyl]methyl ethanoate

Systemtic Name: [3-(acetyloxymethyl)-5-(bromomethyl)cyclohexyl]methyl ethanoate Openeye Name: [3-(acetoxymethyl)-5-(bromomethyl)cyclohexyl]methyl acetate CAS Name: acetic acid [3-(acetyloxymethyl)-5-(bromomethyl)cyclohexyl]methyl ester IUPAC Name: [3-(acetyloxymethyl)-5-(bromomethyl)cyclohexyl]methyl acetate Traditional Name: acetic acid [3-(acetoxymethyl)-5-(bromomethyl)cyclohexyl]methyl ester Formula: C13H21BrO4 MolecularWeight: 321.20744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(CC(C1)CBr)COC(=O)C

Isomeric SMILES

CC(=O)OCC1CC(CC(C1)CBr)COC(=O)C

InChI

InChI=1S/C13H21BrO4/c1-9(15)17-7-12-3-11(6-14)4-13(5-12)8-18-10(2)16/h11-13H,3-8H2,1-2H3