ethyl 7-[2-(3,3-dimethyl-2-oxidanyl-heptyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-(3,3-dimethyl-2-oxidanyl-heptyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethyl-heptyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethylheptyl)thio]cyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethylheptyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethyl-heptyl)thio]cyclopentyl]enanthic acid ethyl ester Formula: C23H44O4S MolecularWeight: 416.65806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CSC1CCC(C1CCCCCCC(=O)OCC)O)O

Isomeric SMILES

CCCCC(C)(C)C(CSC1CCC(C1CCCCCCC(=O)OCC)O)O

InChI

InChI=1S/C23H44O4S/c1-5-7-16-23(3,4)21(25)17-28-20-15-14-19(24)18(20)12-10-8-9-11-13-22(26)27-6-2/h18-21,24-25H,5-17H2,1-4H3