4-hexyl-2,2-dimethyl-6-phenylsulfanyl-1,3-dioxane

Systemtic Name: 4-hexyl-2,2-dimethyl-6-phenylsulfanyl-1,3-dioxane Openeye Name: 4-hexyl-2,2-dimethyl-6-phenylsulfanyl-1,3-dioxane CAS Name: 4-hexyl-2,2-dimethyl-6-(phenylthio)-1,3-dioxane IUPAC Name: 4-hexyl-2,2-dimethyl-6-phenylsulfanyl-1,3-dioxane Traditional Name: 4-hexyl-2,2-dimethyl-6-(phenylthio)-1,3-dioxane Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(OC(O1)(C)C)SC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1CC(OC(O1)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C18H28O2S/c1-4-5-6-8-11-15-14-17(20-18(2,3)19-15)21-16-12-9-7-10-13-16/h7,9-10,12-13,15,17H,4-6,8,11,14H2,1-3H3