2-methyl-6-(5-methyl-6-oxidanyl-5-phenyl-hexyl)sulfanyl-2-phenyl-hexanoic acid

Systemtic Name: 2-methyl-6-(5-methyl-6-oxidanyl-5-phenyl-hexyl)sulfanyl-2-phenyl-hexanoic acid Openeye Name: 6-(6-hydroxy-5-methyl-5-phenyl-hexyl)sulfanyl-2-methyl-2-phenyl-hexanoic acid CAS Name: 6-[(6-hydroxy-5-methyl-5-phenylhexyl)thio]-2-methyl-2-phenylhexanoic acid IUPAC Name: 6-(6-hydroxy-5-methyl-5-phenylhexyl)sulfanyl-2-methyl-2-phenylhexanoic acid Traditional Name: 6-[(6-hydroxy-5-methyl-5-phenyl-hexyl)thio]-2-methyl-2-phenyl-hexanoic acid Formula: C26H36O3S MolecularWeight: 428.62724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCSCCCCC(C)(C1=CC=CC=C1)C(=O)O)(CO)C2=CC=CC=C2

Isomeric SMILES

CC(CCCCSCCCCC(C)(C1=CC=CC=C1)C(=O)O)(CO)C2=CC=CC=C2

InChI

InChI=1S/C26H36O3S/c1-25(21-27,22-13-5-3-6-14-22)17-9-11-19-30-20-12-10-18-26(2,24(28)29)23-15-7-4-8-16-23/h3-8,13-16,27H,9-12,17-21H2,1-2H3,(H,28,29)