3-methyl-6-(4-methyl-6-oxidanyl-4-phenyl-hexyl)sulfinyl-3-phenyl-hexanoic acid

Systemtic Name: 3-methyl-6-(4-methyl-6-oxidanyl-4-phenyl-hexyl)sulfinyl-3-phenyl-hexanoic acid Openeye Name: 6-(6-hydroxy-4-methyl-4-phenyl-hexyl)sulfinyl-3-methyl-3-phenyl-hexanoic acid CAS Name: 6-(6-hydroxy-4-methyl-4-phenylhexyl)sulfinyl-3-methyl-3-phenylhexanoic acid IUPAC Name: 6-(6-hydroxy-4-methyl-4-phenylhexyl)sulfinyl-3-methyl-3-phenylhexanoic acid Traditional Name: 6-(6-hydroxy-4-methyl-4-phenyl-hexyl)sulfinyl-3-methyl-3-phenyl-hexanoic acid Formula: C26H36O4S MolecularWeight: 444.62664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCS(=O)CCCC(C)(CC(=O)O)C1=CC=CC=C1)(CCO)C2=CC=CC=C2

Isomeric SMILES

CC(CCCS(=O)CCCC(C)(CC(=O)O)C1=CC=CC=C1)(CCO)C2=CC=CC=C2

InChI

InChI=1S/C26H36O4S/c1-25(17-18-27,22-11-5-3-6-12-22)15-9-19-31(30)20-10-16-26(2,21-24(28)29)23-13-7-4-8-14-23/h3-8,11-14,27H,9-10,15-21H2,1-2H3,(H,28,29)