2-(12-phenethylsulfanyldodecyl)oxane

Systemtic Name: 2-(12-phenethylsulfanyldodecyl)oxane Openeye Name: 2-(12-phenethylsulfanyldodecyl)tetrahydropyran CAS Name: 2-[12-(phenethylthio)dodecyl]oxane IUPAC Name: 2-(12-phenethylsulfanyldodecyl)oxane Traditional Name: 2-[12-(phenethylthio)dodecyl]tetrahydropyran Formula: C25H42OS MolecularWeight: 390.66538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CCCCCCCCCCCCSCCC2=CC=CC=C2

Isomeric SMILES

C1CCOC(C1)CCCCCCCCCCCCSCCC2=CC=CC=C2

InChI

InChI=1S/C25H42OS/c1(3-5-7-12-18-25-19-13-14-21-26-25)2-4-6-8-15-22-27-23-20-24-16-10-9-11-17-24/h9-11,16-17,25H,1-8,12-15,18-23H2