methyl 4-bromanyl-2-chloranyl-2,5,5-trimethyl-hexanoate

Systemtic Name: methyl 4-bromanyl-2-chloranyl-2,5,5-trimethyl-hexanoate Openeye Name: methyl 4-bromo-2-chloro-2,5,5-trimethyl-hexanoate CAS Name: 4-bromo-2-chloro-2,5,5-trimethylhexanoic acid methyl ester IUPAC Name: methyl 4-bromo-2-chloro-2,5,5-trimethylhexanoate Traditional Name: 4-bromo-2-chloro-2,5,5-trimethyl-hexanoic acid methyl ester Formula: C10H18BrClO2 MolecularWeight: 285.60572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(C)(C(=O)OC)Cl)Br

Isomeric SMILES

CC(C)(C)C(CC(C)(C(=O)OC)Cl)Br

InChI

InChI=1S/C10H18BrClO2/c1-9(2,3)7(11)6-10(4,12)8(13)14-5/h7H,6H2,1-5H3