2-methylpropyl 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-3-oxidanyl-2-phenoxy-butanoate

Systemtic Name: 2-methylpropyl 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-3-oxidanyl-2-phenoxy-butanoate Openeye Name: isobutyl 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-3-hydroxy-2-phenoxy-butanoate CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-3-hydroxy-2-phenoxybutanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-3-hydroxy-2-phenoxybutanoate Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-3-hydroxy-2-phenoxy-butyric acid isobutyl ester Formula: C28H40O5S MolecularWeight: 488.6792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C(C)O)(OC1=CC=CC=C1)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)COC(=O)C(C(C)O)(OC1=CC=CC=C1)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C28H40O5S/c1-18(2)17-32-25(31)28(19(3)29,33-20-13-11-10-12-14-20)34-21-15-22(26(4,5)6)24(30)23(16-21)27(7,8)9/h10-16,18-19,29-30H,17H2,1-9H3