decyl 7-[2-(2-methyl-2-oxidanyl-3-phenyl-propyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: decyl 7-[2-(2-methyl-2-oxidanyl-3-phenyl-propyl)sulfanyl-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: decyl 7-[2-hydroxy-5-(2-hydroxy-2-methyl-3-phenyl-propyl)sulfanyl-cyclopentyl]heptanoate CAS Name: 7-[2-hydroxy-5-[(2-hydroxy-2-methyl-3-phenylpropyl)thio]cyclopentyl]heptanoic acid decyl ester IUPAC Name: decyl 7-[2-hydroxy-5-(2-hydroxy-2-methyl-3-phenylpropyl)sulfanylcyclopentyl]heptanoate Traditional Name: 7-[2-hydroxy-5-[(2-hydroxy-2-methyl-3-phenyl-propyl)thio]cyclopentyl]enanthic acid decyl ester Formula: C32H54O4S MolecularWeight: 534.83376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1SCC(C)(CC2=CC=CC=C2)O)O

Isomeric SMILES

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1SCC(C)(CC2=CC=CC=C2)O)O

InChI

InChI=1S/C32H54O4S/c1-3-4-5-6-7-8-11-17-24-36-31(34)21-16-10-9-15-20-28-29(33)22-23-30(28)37-26-32(2,35)25-27-18-13-12-14-19-27/h12-14,18-19,28-30,33,35H,3-11,15-17,20-26H2,1-2H3