[(2S)-1-phenoxypropan-2-yl] butanoate

Systemtic Name: [(2S)-1-phenoxypropan-2-yl] butanoate Openeye Name: [(1S)-1-methyl-2-phenoxy-ethyl] butanoate CAS Name: butanoic acid [(2S)-1-phenoxypropan-2-yl] ester IUPAC Name: [(2S)-1-phenoxypropan-2-yl] butanoate Traditional Name: butyric acid [(1S)-1-methyl-2-phenoxy-ethyl] ester Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C)COC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)O[C@@H](C)COC1=CC=CC=C1

InChI

InChI=1S/C13H18O3/c1-3-7-13(14)16-11(2)10-15-12-8-5-4-6-9-12/h4-6,8-9,11H,3,7,10H2,1-2H3/t11-/m0/s1