7-[2-oxidanylidene-5-(2,8,8-trimethyl-2-oxidanyl-nonyl)sulfanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-oxidanylidene-5-(2,8,8-trimethyl-2-oxidanyl-nonyl)sulfanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-2,8,8-trimethyl-nonyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-2,8,8-trimethylnonyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-2,8,8-trimethylnonyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-2,8,8-trimethyl-nonyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C24H44O4S MolecularWeight: 428.66876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCC(C)(CSC1CCC(=O)C1CCCCCCC(=O)O)O

Isomeric SMILES

CC(C)(C)CCCCCC(C)(CSC1CCC(=O)C1CCCCCCC(=O)O)O

InChI

InChI=1S/C24H44O4S/c1-23(2,3)16-10-7-11-17-24(4,28)18-29-21-15-14-20(25)19(21)12-8-5-6-9-13-22(26)27/h19,21,28H,5-18H2,1-4H3,(H,26,27)