[(2R,3S)-6-bromanyl-3-methyl-hexan-2-yl]oxymethylbenzene

Systemtic Name: [(2R,3S)-6-bromanyl-3-methyl-hexan-2-yl]oxymethylbenzene Openeye Name: [(1R,2S)-5-bromo-1,2-dimethyl-pentoxy]methylbenzene CAS Name: [(2R,3S)-6-bromo-3-methylhexan-2-yl]oxymethylbenzene IUPAC Name: [(2R,3S)-6-bromo-3-methylhexan-2-yl]oxymethylbenzene Traditional Name: [(1R,2S)-5-bromo-1,2-dimethyl-pentoxy]methylbenzene Formula: C14H21BrO MolecularWeight: 285.21994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCBr)C(C)OCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCCBr)[C@@H](C)OCC1=CC=CC=C1

InChI

InChI=1S/C14H21BrO/c1-12(7-6-10-15)13(2)16-11-14-8-4-3-5-9-14/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3/t12-,13+/m0/s1