ethyl 7-ethanoylsulfanyl-3,7-dimethyl-octanoate

Systemtic Name: ethyl 7-ethanoylsulfanyl-3,7-dimethyl-octanoate Openeye Name: ethyl 7-acetylsulfanyl-3,7-dimethyl-octanoate CAS Name: 7-(acetylthio)-3,7-dimethyloctanoic acid ethyl ester IUPAC Name: ethyl 7-acetylsulfanyl-3,7-dimethyloctanoate Traditional Name: 7-(acetylthio)-3,7-dimethyl-caprylic acid ethyl ester Formula: C14H26O3S MolecularWeight: 274.41944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)CCCC(C)(C)SC(=O)C

Isomeric SMILES

CCOC(=O)CC(C)CCCC(C)(C)SC(=O)C

InChI

InChI=1S/C14H26O3S/c1-6-17-13(16)10-11(2)8-7-9-14(4,5)18-12(3)15/h11H,6-10H2,1-5H3