S-methyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanethioate

Systemtic Name: S-methyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanethioate Openeye Name: S-methyl 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanethioate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanethioic acid S-methyl ester IUPAC Name: S-methyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanethioate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanethioic acid S-methyl ester Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)SC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)SC

InChI

InChI=1S/C18H28O2S/c1-17(2,3)13-10-12(8-9-15(19)21-7)11-14(16(13)20)18(4,5)6/h10-11,20H,8-9H2,1-7H3