[(2S,7S)-1-methyl-2,7-bis(oxidanyl)cycloheptyl]methyl 2,2-dimethylpropanoate

Systemtic Name: [(2S,7S)-1-methyl-2,7-bis(oxidanyl)cycloheptyl]methyl 2,2-dimethylpropanoate Openeye Name: [(2S,7S)-2,7-dihydroxy-1-methyl-cycloheptyl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2S,7S)-2,7-dihydroxy-1-methylcycloheptyl]methyl ester IUPAC Name: [(2S,7S)-2,7-dihydroxy-1-methylcycloheptyl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2S,7S)-2,7-dihydroxy-1-methyl-cycloheptyl]methyl ester Formula: C14H26O4 MolecularWeight: 258.35384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCCCC1O)O)COC(=O)C(C)(C)C

Isomeric SMILES

CC1([C@H](CCCC[C@@H]1O)O)COC(=O)C(C)(C)C

InChI

InChI=1S/C14H26O4/c1-13(2,3)12(17)18-9-14(4)10(15)7-5-6-8-11(14)16/h10-11,15-16H,5-9H2,1-4H3/t10-,11-/m0/s1