[(7S)-7-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-9-methyl-decyl] 2,2-dimethylpropanoate

Systemtic Name: [(7S)-7-[(2S)-2-acetyloxy-2-phenyl-ethanoyl]oxy-9-methyl-decyl] 2,2-dimethylpropanoate Openeye Name: [(7S)-7-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-9-methyl-decyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(7S)-7-[(2S)-2-acetyloxy-1-oxo-2-phenylethoxy]-9-methyldecyl] ester IUPAC Name: [(7S)-7-[(2S)-2-acetyloxy-2-phenylacetyl]oxy-9-methyldecyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(7S)-7-[(2S)-2-acetoxy-2-phenyl-acetyl]oxy-9-methyl-decyl] ester Formula: C26H40O6 MolecularWeight: 448.5922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CCCCCCOC(=O)C(C)(C)C)OC(=O)C(C1=CC=CC=C1)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C26H40O6/c1-19(2)18-22(16-12-7-8-13-17-30-25(29)26(4,5)6)32-24(28)23(31-20(3)27)21-14-10-9-11-15-21/h9-11,14-15,19,22-23H,7-8,12-13,16-18H2,1-6H3/t22-,23-/m0/s1