5-[4-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropyl]phenoxy]-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-[4-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropyl]phenoxy]-2,2-dimethyl-pentanoic acid Openeye Name: 5-[4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpropyl]phenoxy]-2,2-dimethyl-pentanoic acid CAS Name: 5-[4-[3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propyl]phenoxy]-2,2-dimethylpentanoic acid IUPAC Name: 5-[4-[3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropyl]phenoxy]-2,2-dimethylpentanoic acid Traditional Name: 5-[4-[3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]propyl]phenoxy]-2,2-dimethyl-valeric acid Formula: C30H44O4S MolecularWeight: 500.73296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCCC2=CC=C(C=C2)OCCCC(C)(C)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCCC2=CC=C(C=C2)OCCCC(C)(C)C(=O)O

InChI

InChI=1S/C30H44O4S/c1-28(2,3)24-19-23(20-25(26(24)31)29(4,5)6)35-18-9-11-21-12-14-22(15-13-21)34-17-10-16-30(7,8)27(32)33/h12-15,19-20,31H,9-11,16-18H2,1-8H3,(H,32,33)