1-[2,4-bis(tert-butylsulfanyl)-3-oxidanyl-phenyl]pentyl ethanoate

Systemtic Name: 1-[2,4-bis(tert-butylsulfanyl)-3-oxidanyl-phenyl]pentyl ethanoate Openeye Name: 1-[2,4-bis(tert-butylsulfanyl)-3-hydroxy-phenyl]pentyl acetate CAS Name: acetic acid 1-[2,4-bis(tert-butylthio)-3-hydroxyphenyl]pentyl ester IUPAC Name: 1-[2,4-bis(tert-butylsulfanyl)-3-hydroxyphenyl]pentyl acetate Traditional Name: acetic acid 1-[2,4-bis(tert-butylthio)-3-hydroxy-phenyl]pentyl ester Formula: C21H34O3S2 MolecularWeight: 398.62286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(C(=C(C=C1)SC(C)(C)C)O)SC(C)(C)C)OC(=O)C

Isomeric SMILES

CCCCC(C1=C(C(=C(C=C1)SC(C)(C)C)O)SC(C)(C)C)OC(=O)C

InChI

InChI=1S/C21H34O3S2/c1-9-10-11-16(24-14(2)22)15-12-13-17(25-20(3,4)5)18(23)19(15)26-21(6,7)8/h12-13,16,23H,9-11H2,1-8H3