decyl 7-[2-(3,3-dimethyl-2-oxidanyl-nonyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: decyl 7-[2-(3,3-dimethyl-2-oxidanyl-nonyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: decyl 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethyl-nonyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethylnonyl)thio]cyclopentyl]heptanoic acid decyl ester IUPAC Name: decyl 7-[2-hydroxy-5-(2-hydroxy-3,3-dimethylnonyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-3,3-dimethyl-nonyl)thio]cyclopentyl]enanthic acid decyl ester Formula: C33H64O4S MolecularWeight: 556.92386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H64O4S/c1-5-7-9-11-12-13-16-20-26-37-32(36)22-18-15-14-17-21-28-29(34)23-24-30(28)38-27-31(35)33(3,4)25-19-10-8-6-2/h28-31,34-35H,5-27H2,1-4H3