2-[[2,4,6-trimethyl-3-(2-methylundecan-2-ylsulfanylmethyl)-5-oxidanyl-phenyl]methylsulfanyl]ethyl ethanoate

Systemtic Name: 2-[[2,4,6-trimethyl-3-(2-methylundecan-2-ylsulfanylmethyl)-5-oxidanyl-phenyl]methylsulfanyl]ethyl ethanoate Openeye Name: 2-[[3-(1,1-dimethyldecylsulfanylmethyl)-5-hydroxy-2,4,6-trimethyl-phenyl]methylsulfanyl]ethyl acetate CAS Name: acetic acid 2-[[3-hydroxy-2,4,6-trimethyl-5-[(2-methylundecan-2-ylthio)methyl]phenyl]methylthio]ethyl ester IUPAC Name: 2-[[3-hydroxy-2,4,6-trimethyl-5-(2-methylundecan-2-ylsulfanylmethyl)phenyl]methylsulfanyl]ethyl acetate Traditional Name: acetic acid 2-[[3-[(1,1-dimethyldecylthio)methyl]-5-hydroxy-2,4,6-trimethyl-benzyl]thio]ethyl ester Formula: C27H46O3S2 MolecularWeight: 482.78234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C)SCC1=C(C(=C(C(=C1C)CSCCOC(=O)C)C)O)C

Isomeric SMILES

CCCCCCCCCC(C)(C)SCC1=C(C(=C(C(=C1C)CSCCOC(=O)C)C)O)C

InChI

InChI=1S/C27H46O3S2/c1-8-9-10-11-12-13-14-15-27(6,7)32-19-25-20(2)24(21(3)26(29)22(25)4)18-31-17-16-30-23(5)28/h29H,8-19H2,1-7H3