[(3S,5S)-3-oxidanylundecan-5-yl] 2,2-dimethylpropanoate

Systemtic Name: [(3S,5S)-3-oxidanylundecan-5-yl] 2,2-dimethylpropanoate Openeye Name: [(1S)-1-[(2S)-2-hydroxybutyl]heptyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(3S,5S)-3-hydroxyundecan-5-yl] ester IUPAC Name: [(3S,5S)-3-hydroxyundecan-5-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1S)-1-[(2S)-2-hydroxybutyl]heptyl] ester Formula: C16H32O3 MolecularWeight: 272.42348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(CC)O)OC(=O)C(C)(C)C

Isomeric SMILES

CCCCCC[C@@H](C[C@H](CC)O)OC(=O)C(C)(C)C

InChI

InChI=1S/C16H32O3/c1-6-8-9-10-11-14(12-13(17)7-2)19-15(18)16(3,4)5/h13-14,17H,6-12H2,1-5H3/t13-,14-/m0/s1