(phenylmethyl) 2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanoate Openeye Name: benzyl 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylsulfanyl]acetate CAS Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylthio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]acetate Traditional Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylthio]acetic acid benzyl ester Formula: C26H36O3S MolecularWeight: 428.62724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H36O3S/c1-25(2,3)21-15-20(16-22(24(21)28)26(4,5)6)13-10-14-30-18-23(27)29-17-19-11-8-7-9-12-19/h7-9,11-12,15-16,28H,10,13-14,17-18H2,1-6H3