methyl 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanoate

Systemtic Name: methyl 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanoate Openeye Name: methyl 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpropanoate CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropanoate Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]propionic acid methyl ester Formula: C18H28O3S MolecularWeight: 324.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C(=O)OC)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C18H28O3S/c1-11(16(20)21-8)22-12-9-13(17(2,3)4)15(19)14(10-12)18(5,6)7/h9-11,19H,1-8H3