(2S)-2-[(2S)-octan-2-yl]oxy-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(2S)-octan-2-yl]oxy-2-phenyl-ethanoate Openeye Name: (2S)-2-[(1S)-1-methylheptoxy]-2-phenyl-acetate CAS Name: (2S)-2-[(2S)-octan-2-yl]oxy-2-phenylacetate IUPAC Name: (2S)-2-[(2S)-octan-2-yl]oxy-2-phenylacetate Traditional Name: (2S)-2-[(1S)-1-methylheptoxy]-2-phenyl-acetate Formula: C16H23O3- MolecularWeight: 263.35202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(C1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CCCCCC[C@H](C)O[C@@H](C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C16H24O3/c1-3-4-5-7-10-13(2)19-15(16(17)18)14-11-8-6-9-12-14/h6,8-9,11-13,15H,3-5,7,10H2,1-2H3,(H,17,18)/p-1/t13-,15-/m0/s1