(2R)-2-hexylsulfanyl-1-(5-methyl-2-oxidanyl-phenyl)octan-1-one

Systemtic Name: (2R)-2-hexylsulfanyl-1-(5-methyl-2-oxidanyl-phenyl)octan-1-one Openeye Name: (2R)-2-hexylsulfanyl-1-(2-hydroxy-5-methyl-phenyl)octan-1-one CAS Name: (2R)-2-(hexylthio)-1-(2-hydroxy-5-methylphenyl)-1-octanone IUPAC Name: (2R)-2-hexylsulfanyl-1-(2-hydroxy-5-methylphenyl)octan-1-one Traditional Name: (2R)-2-(hexylthio)-1-(2-hydroxy-5-methyl-phenyl)octan-1-one Formula: C21H34O2S MolecularWeight: 350.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)C1=C(C=CC(=C1)C)O)SCCCCCC

Isomeric SMILES

CCCCCC[C@H](C(=O)C1=C(C=CC(=C1)C)O)SCCCCCC

InChI

InChI=1S/C21H34O2S/c1-4-6-8-10-12-20(24-15-11-9-7-5-2)21(23)18-16-17(3)13-14-19(18)22/h13-14,16,20,22H,4-12,15H2,1-3H3/t20-/m1/s1