decyl 7-[2-(8,8-dimethyl-2-oxidanyl-nonyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: decyl 7-[2-(8,8-dimethyl-2-oxidanyl-nonyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: decyl 7-[2-hydroxy-5-(2-hydroxy-8,8-dimethyl-nonyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-8,8-dimethylnonyl)thio]cyclopentyl]heptanoic acid decyl ester IUPAC Name: decyl 7-[2-hydroxy-5-(2-hydroxy-8,8-dimethylnonyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-8,8-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(CCCCCC(C)(C)C)O)O

Isomeric SMILES

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

InChI

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