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

Systemtic Name: (2R)-2-butylsulfanyl-1-(5-methyl-2-oxidanyl-phenyl)octan-1-one Openeye Name: (2R)-2-butylsulfanyl-1-(2-hydroxy-5-methyl-phenyl)octan-1-one CAS Name: (2R)-2-(butylthio)-1-(2-hydroxy-5-methylphenyl)-1-octanone IUPAC Name: (2R)-2-butylsulfanyl-1-(2-hydroxy-5-methylphenyl)octan-1-one Traditional Name: (2R)-2-(butylthio)-1-(2-hydroxy-5-methyl-phenyl)octan-1-one Formula: C19H30O2S MolecularWeight: 322.5053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O2S/c1-4-6-8-9-10-18(22-13-7-5-2)19(21)16-14-15(3)11-12-17(16)20/h11-12,14,18,20H,4-10,13H2,1-3H3/t18-/m1/s1