[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methyl-octadecyl] 3-propylsulfonylpropanoate

Systemtic Name: [3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methyl-octadecyl] 3-propylsulfonylpropanoate Openeye Name: [3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-methyl-octadecyl] 3-propylsulfonylpropanoate CAS Name: 3-propylsulfonylpropanoic acid [3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methyloctadecyl] ester IUPAC Name: [3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methyloctadecyl] 3-propylsulfonylpropanoate Traditional Name: 3-propylsulfonylpropionic acid [3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-methyl-octadecyl] ester Formula: C39H70O5S MolecularWeight: 651.0351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(C)COC(=O)CCS(=O)(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(C)COC(=O)CCS(=O)(=O)CCC

InChI

InChI=1S/C39H70O5S/c1-10-12-13-14-15-16-17-18-19-20-21-22-23-24-33(31(3)30-44-36(40)25-27-45(42,43)26-11-2)32-28-34(38(4,5)6)37(41)35(29-32)39(7,8)9/h28-29,31,33,41H,10-27,30H2,1-9H3