(2S)-2-[(2S)-2-ethylhexoxy]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(2S)-2-ethylhexoxy]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(2S)-2-ethylhexoxy]-2-phenyl-acetate CAS Name: (2S)-2-[(2S)-2-ethylhexoxy]-2-phenylacetate IUPAC Name: (2S)-2-[(2S)-2-ethylhexoxy]-2-phenylacetate Traditional Name: (2S)-2-[(2S)-2-ethylhexoxy]-2-phenyl-acetate Formula: C16H23O3- MolecularWeight: 263.35202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(C1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

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

InChI

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