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1,5,9-tris(hexadecylsulfanyl)cyclododecane

1,5,9-tris(hexadecylsulfanyl)cyclododecane

Systemtic Name:1,5,9-tris(hexadecylsulfanyl)cyclododecane
Openeye Name:1,5,9-tris(hexadecylsulfanyl)cyclododecane
CAS Name:1,5,9-tris(hexadecylthio)cyclododecane
IUPAC Name:1,5,9-tris(hexadecylsulfanyl)cyclododecane
Traditional Name:1,5,9-tris(cetylthio)cyclododecane
Formula: C60H120S3
MolecularWeight: 937.7898
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1CCCC(CCCC(CCC1)SCCCCCCCCCCCCCCCC)SCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCSC1CCCC(CCCC(CCC1)SCCCCCCCCCCCCCCCC)SCCCCCCCCCCCCCCCC


InChI

InChI=1S/C60H120S3/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-55-61-58-49-46-51-59(62-56-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)53-48-54-60(52-47-50-58)63-57-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h58-60H,4-57H2,1-3H3


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