[(2R,9S)-1,10-bis(tert-butylsulfanyl)-9-oxidanyl-decan-2-yl] ethanoate

Systemtic Name: [(2R,9S)-1,10-bis(tert-butylsulfanyl)-9-oxidanyl-decan-2-yl] ethanoate Openeye Name: [(1R,8S)-9-tert-butylsulfanyl-1-(tert-butylsulfanylmethyl)-8-hydroxy-nonyl] acetate CAS Name: acetic acid [(2R,9S)-1,10-bis(tert-butylthio)-9-hydroxydecan-2-yl] ester IUPAC Name: [(2R,9S)-1,10-bis(tert-butylsulfanyl)-9-hydroxydecan-2-yl] acetate Traditional Name: acetic acid [(1R,8S)-9-(tert-butylthio)-1-[(tert-butylthio)methyl]-8-hydroxy-nonyl] ester Formula: C20H40O3S2 MolecularWeight: 392.6598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H40O3S2/c1-16(21)23-18(15-25-20(5,6)7)13-11-9-8-10-12-17(22)14-24-19(2,3)4/h17-18,22H,8-15H2,1-7H3/t17-,18+/m0/s1