[(4S)-4-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-4-cyclohexyl-butyl] 2,2-dimethylpropanoate

Systemtic Name: [(4S)-4-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-4-cyclohexyl-butyl] 2,2-dimethylpropanoate Openeye Name: [(4S)-4-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-4-cyclohexyl-butyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(4S)-4-[(2S)-2-acetyloxy-1-oxo-2-phenylethoxy]-4-cyclohexylbutyl] ester IUPAC Name: [(4S)-4-[(2S)-2-acetyloxy-2-phenylacetyl]oxy-4-cyclohexylbutyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(4S)-4-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-4-cyclohexyl-butyl] ester Formula: C25H36O6 MolecularWeight: 432.54974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(=O)OC(CCCOC(=O)C(C)(C)C)C2CCCCC2

Isomeric SMILES

CC(=O)O[C@@H](C1=CC=CC=C1)C(=O)O[C@@H](CCCOC(=O)C(C)(C)C)C2CCCCC2

InChI

InChI=1S/C25H36O6/c1-18(26)30-22(20-14-9-6-10-15-20)23(27)31-21(19-12-7-5-8-13-19)16-11-17-29-24(28)25(2,3)4/h6,9-10,14-15,19,21-22H,5,7-8,11-13,16-17H2,1-4H3/t21-,22-/m0/s1