2-dodecylsulfanylethyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: 2-dodecylsulfanylethyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoate Openeye Name: 2-dodecylsulfanylethyl 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid 2-(dodecylthio)ethyl ester IUPAC Name: 2-dodecylsulfanylethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid 2-(laurylthio)ethyl ester Formula: C31H54O3S MolecularWeight: 506.82366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCOC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCSCCOC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C31H54O3S/c1-8-9-10-11-12-13-14-15-16-17-21-35-22-20-34-28(32)19-18-25-23-26(30(2,3)4)29(33)27(24-25)31(5,6)7/h23-24,33H,8-22H2,1-7H3