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

Systemtic Name: 7-[2-oxidanylidene-5-(2-oxidanyl-5-phenyl-pentyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-5-phenyl-pentyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-5-phenylpentyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-5-phenylpentyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-5-phenyl-pentyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C23H34O4S MolecularWeight: 406.57866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1SCC(CCCC2=CC=CC=C2)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1SCC(CCCC2=CC=CC=C2)O)CCCCCCC(=O)O

InChI

InChI=1S/C23H34O4S/c24-19(12-8-11-18-9-4-3-5-10-18)17-28-22-16-15-21(25)20(22)13-6-1-2-7-14-23(26)27/h3-5,9-10,19-20,22,24H,1-2,6-8,11-17H2,(H,26,27)