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

Systemtic Name: ethyl 7-[2-oxidanyl-5-(2,3,3-trimethyl-2-oxidanyl-heptyl)sulfanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-2,3,3-trimethyl-heptyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-2,3,3-trimethylheptyl)thio]cyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-hydroxy-5-(2-hydroxy-2,3,3-trimethylheptyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-2,3,3-trimethyl-heptyl)thio]cyclopentyl]enanthic acid ethyl ester Formula: C24H46O4S MolecularWeight: 430.68464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H46O4S/c1-6-8-17-23(3,4)24(5,27)18-29-21-16-15-20(25)19(21)13-11-9-10-12-14-22(26)28-7-2/h19-21,25,27H,6-18H2,1-5H3