[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2,2-dimethyl-propyl] 3-sulfanylpropanoate

Systemtic Name: [3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2,2-dimethyl-propyl] 3-sulfanylpropanoate Openeye Name: [3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2,2-dimethyl-propyl] 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoic acid [3-(3,5-ditert-butyl-4-hydroxyphenyl)-2,2-dimethylpropyl] ester IUPAC Name: [3-(3,5-ditert-butyl-4-hydroxyphenyl)-2,2-dimethylpropyl] 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionic acid [3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2,2-dimethyl-propyl] ester Formula: C22H36O3S MolecularWeight: 380.58444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C)(C)COC(=O)CCS

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C)(C)COC(=O)CCS

InChI

InChI=1S/C22H36O3S/c1-20(2,3)16-11-15(12-17(19(16)24)21(4,5)6)13-22(7,8)14-25-18(23)9-10-26/h11-12,24,26H,9-10,13-14H2,1-8H3