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

Systemtic Name: 7-[2-oxidanylidene-5-(2-oxidanyl-7-phenyl-heptyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-7-phenyl-heptyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-7-phenylheptyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-7-phenylheptyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-7-phenyl-heptyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C25H38O4S MolecularWeight: 434.63182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1SCC(CCCCCC2=CC=CC=C2)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1SCC(CCCCCC2=CC=CC=C2)O)CCCCCCC(=O)O

InChI

InChI=1S/C25H38O4S/c26-21(14-8-4-7-13-20-11-5-3-6-12-20)19-30-24-18-17-23(27)22(24)15-9-1-2-10-16-25(28)29/h3,5-6,11-12,21-22,24,26H,1-2,4,7-10,13-19H2,(H,28,29)