[(2S)-2-phenoxypropyl] octanoate

Systemtic Name: [(2S)-2-phenoxypropyl] octanoate Openeye Name: [(2S)-2-phenoxypropyl] octanoate CAS Name: octanoic acid [(2S)-2-phenoxypropyl] ester IUPAC Name: [(2S)-2-phenoxypropyl] octanoate Traditional Name: caprylic acid [(2S)-2-phenoxypropyl] ester Formula: C17H26O3 MolecularWeight: 278.38654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(C)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(=O)OC[C@H](C)OC1=CC=CC=C1

InChI

InChI=1S/C17H26O3/c1-3-4-5-6-10-13-17(18)19-14-15(2)20-16-11-8-7-9-12-16/h7-9,11-12,15H,3-6,10,13-14H2,1-2H3/t15-/m0/s1