[(3R,4S)-1,1,3-tris(bromanyl)-4-methyl-dec-1-en-4-yl] ethanoate

Systemtic Name: [(3R,4S)-1,1,3-tris(bromanyl)-4-methyl-dec-1-en-4-yl] ethanoate Openeye Name: [(1S)-1-methyl-1-[(1R)-1,3,3-tribromoallyl]heptyl] acetate CAS Name: acetic acid [(3R,4S)-1,1,3-tribromo-4-methyldec-1-en-4-yl] ester IUPAC Name: [(3R,4S)-1,1,3-tribromo-4-methyldec-1-en-4-yl] acetate Traditional Name: acetic acid [(1S,2R)-2,4,4-tribromo-1-hexyl-1-methyl-but-3-enyl] ester Formula: C13H21Br3O2 MolecularWeight: 449.01664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C(C=C(Br)Br)Br)OC(=O)C

Isomeric SMILES

CCCCCC[C@@](C)([C@@H](C=C(Br)Br)Br)OC(=O)C

InChI

InChI=1S/C13H21Br3O2/c1-4-5-6-7-8-13(3,18-10(2)17)11(14)9-12(15)16/h9,11H,4-8H2,1-3H3/t11-,13+/m1/s1