7-[2-oxidanylidene-5-(2-oxidanyl-6-phenyl-hexyl)sulfanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-oxidanylidene-5-(2-oxidanyl-6-phenyl-hexyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-6-phenyl-hexyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-6-phenylhexyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-6-phenylhexyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-6-phenyl-hexyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C24H36O4S MolecularWeight: 420.60524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1SCC(CCCCC2=CC=CC=C2)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1SCC(CCCCC2=CC=CC=C2)O)CCCCCCC(=O)O

InChI

InChI=1S/C24H36O4S/c25-20(13-9-8-12-19-10-4-3-5-11-19)18-29-23-17-16-22(26)21(23)14-6-1-2-7-15-24(27)28/h3-5,10-11,20-21,23,25H,1-2,6-9,12-18H2,(H,27,28)