(3S,6Z)-6-(butylsulfanylmethylidene)-2,2-dimethyl-3-(oxan-2-yloxy)cyclohexan-1-one

Systemtic Name: (3S,6Z)-6-(butylsulfanylmethylidene)-2,2-dimethyl-3-(oxan-2-yloxy)cyclohexan-1-one Openeye Name: (3S,6Z)-6-(butylsulfanylmethylene)-2,2-dimethyl-3-tetrahydropyran-2-yloxy-cyclohexanone CAS Name: (3S,6Z)-6-[(butylthio)methylidene]-2,2-dimethyl-3-(2-oxanyloxy)-1-cyclohexanone IUPAC Name: (3S,6Z)-6-(butylsulfanylmethylidene)-2,2-dimethyl-3-(oxan-2-yloxy)cyclohexan-1-one Traditional Name: (3S,6Z)-6-[(butylthio)methylene]-2,2-dimethyl-3-tetrahydropyran-2-yloxy-cyclohexanone Formula: C18H30O3S MolecularWeight: 326.494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC=C1CCC(C(C1=O)(C)C)OC2CCCCO2

Isomeric SMILES

CCCCS/C=C\1/CC[C@@H](C(C1=O)(C)C)OC2CCCCO2

InChI

InChI=1S/C18H30O3S/c1-4-5-12-22-13-14-9-10-15(18(2,3)17(14)19)21-16-8-6-7-11-20-16/h13,15-16H,4-12H2,1-3H3/b14-13-/t15-,16?/m0/s1