7-[2-oxidanylidene-5-(2-oxidanyl-4-phenyl-butyl)sulfanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-oxidanylidene-5-(2-oxidanyl-4-phenyl-butyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-4-phenyl-butyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-4-phenylbutyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-4-phenylbutyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-4-phenyl-butyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C22H32O4S MolecularWeight: 392.55208

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1SCC(CCC2=CC=CC=C2)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1SCC(CCC2=CC=CC=C2)O)CCCCCCC(=O)O

InChI

InChI=1S/C22H32O4S/c23-18(13-12-17-8-4-3-5-9-17)16-27-21-15-14-20(24)19(21)10-6-1-2-7-11-22(25)26/h3-5,8-9,18-19,21,23H,1-2,6-7,10-16H2,(H,25,26)