O-tridecyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanethioate

Systemtic Name: O-tridecyl 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanethioate Openeye Name: O-tridecyl 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanethioate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanethioic acid O-tridecyl ester IUPAC Name: O-tridecyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanethioate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanethioic acid O-tridecyl ester Formula: C30H52O2S MolecularWeight: 476.79768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=S)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCOC(=S)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C30H52O2S/c1-8-9-10-11-12-13-14-15-16-17-18-21-32-27(33)20-19-24-22-25(29(2,3)4)28(31)26(23-24)30(5,6)7/h22-23,31H,8-21H2,1-7H3