[(5S)-5-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-5-(cyclohexen-1-yl)pentyl] 2,2-dimethylpropanoate

Systemtic Name: [(5S)-5-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-5-(cyclohexen-1-yl)pentyl] 2,2-dimethylpropanoate Openeye Name: [(5S)-5-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-5-(cyclohexen-1-yl)pentyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(5S)-5-[(2S)-2-acetyloxy-1-oxo-2-phenylethoxy]-5-(1-cyclohexenyl)pentyl] ester IUPAC Name: [(5S)-5-[(2S)-2-acetyloxy-2-phenylacetyl]oxy-5-(cyclohexen-1-yl)pentyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(5S)-5-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-5-(cyclohexen-1-yl)pentyl] ester Formula: C26H36O6 MolecularWeight: 444.56044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(=O)OC(CCCCOC(=O)C(C)(C)C)C2=CCCCC2

Isomeric SMILES

CC(=O)O[C@@H](C1=CC=CC=C1)C(=O)O[C@@H](CCCCOC(=O)C(C)(C)C)C2=CCCCC2

InChI

InChI=1S/C26H36O6/c1-19(27)31-23(21-15-9-6-10-16-21)24(28)32-22(20-13-7-5-8-14-20)17-11-12-18-30-25(29)26(2,3)4/h6,9-10,13,15-16,22-23H,5,7-8,11-12,14,17-18H2,1-4H3/t22-,23-/m0/s1