S-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)pentyl] ethanethioate

Systemtic Name: S-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)pentyl] ethanethioate Openeye Name: S-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)pentyl] ethanethioate CAS Name: ethanethioic acid S-[1-(3,5-ditert-butyl-4-hydroxyphenyl)pentyl] ester IUPAC Name: S-[1-(3,5-ditert-butyl-4-hydroxyphenyl)pentyl] ethanethioate Traditional Name: ethanethioic acid S-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)pentyl] ester Formula: C21H34O2S MolecularWeight: 350.55846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34O2S/c1-9-10-11-18(24-14(2)22)15-12-16(20(3,4)5)19(23)17(13-15)21(6,7)8/h12-13,18,23H,9-11H2,1-8H3