7-[2-(2,3-dimethyl-2-oxidanyl-3-phenyl-butyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-(2,3-dimethyl-2-oxidanyl-3-phenyl-butyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(2-hydroxy-2,3-dimethyl-3-phenyl-butyl)sulfanyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(2-hydroxy-2,3-dimethyl-3-phenylbutyl)thio]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(2-hydroxy-2,3-dimethyl-3-phenylbutyl)sulfanyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(2-hydroxy-2,3-dimethyl-3-phenyl-butyl)thio]-5-keto-cyclopentyl]enanthic acid Formula: C24H36O4S MolecularWeight: 420.60524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(C)(CSC2CCC(=O)C2CCCCCCC(=O)O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(C)(CSC2CCC(=O)C2CCCCCCC(=O)O)O

InChI

InChI=1S/C24H36O4S/c1-23(2,18-11-7-6-8-12-18)24(3,28)17-29-21-16-15-20(25)19(21)13-9-4-5-10-14-22(26)27/h6-8,11-12,19,21,28H,4-5,9-10,13-17H2,1-3H3,(H,26,27)