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

Systemtic Name: decyl 7-[2-oxidanyl-5-(2,3,3-trimethyl-2-oxidanyl-heptyl)sulfanyl-cyclopentyl]heptanoate Openeye Name: decyl 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 decyl ester IUPAC Name: decyl 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 decyl ester Formula: C32H62O4S MolecularWeight: 542.89728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1SCC(C)(C(C)(C)CCCC)O)O

Isomeric SMILES

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1SCC(C)(C(C)(C)CCCC)O)O

InChI

InChI=1S/C32H62O4S/c1-6-8-10-11-12-13-16-19-25-36-30(34)21-18-15-14-17-20-27-28(33)22-23-29(27)37-26-32(5,35)31(3,4)24-9-7-2/h27-29,33,35H,6-26H2,1-5H3