4-methyl-8-(5-methyl-8-oxidanyl-5-phenyl-octyl)sulfanyl-4-phenyl-octanoic acid

Systemtic Name: 4-methyl-8-(5-methyl-8-oxidanyl-5-phenyl-octyl)sulfanyl-4-phenyl-octanoic acid Openeye Name: 8-(8-hydroxy-5-methyl-5-phenyl-octyl)sulfanyl-4-methyl-4-phenyl-octanoic acid CAS Name: 8-[(8-hydroxy-5-methyl-5-phenyloctyl)thio]-4-methyl-4-phenyloctanoic acid IUPAC Name: 8-(8-hydroxy-5-methyl-5-phenyloctyl)sulfanyl-4-methyl-4-phenyloctanoic acid Traditional Name: 8-[(8-hydroxy-5-methyl-5-phenyl-octyl)thio]-4-methyl-4-phenyl-caprylic acid Formula: C30H44O3S MolecularWeight: 484.73356

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCSCCCCC(C)(CCC(=O)O)C1=CC=CC=C1)(CCCO)C2=CC=CC=C2

Isomeric SMILES

CC(CCCCSCCCCC(C)(CCC(=O)O)C1=CC=CC=C1)(CCCO)C2=CC=CC=C2

InChI

InChI=1S/C30H44O3S/c1-29(21-13-23-31,26-14-5-3-6-15-26)19-9-11-24-34-25-12-10-20-30(2,22-18-28(32)33)27-16-7-4-8-17-27/h3-8,14-17,31H,9-13,18-25H2,1-2H3,(H,32,33)